Diazepam
fo-54ec5c01935fda41
Identity
- Type
- Neutral molecule
- CAS
- 439-14-5
- EC
- 207-122-5
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 57 across every transformer
Structure
What it is used for
1
Roles, not types. A substance bears as many as apply — sulfluramid is an
insecticide and an acaricide — and each is a class ChEBI curates, asserted
with ChEBI’s own has role. The narrow ones publish the broad
ones alongside them, so a substance filed as a herbicide is a pesticide
here too. See agricultural
chemicals for what the axis is and which classes are published.
| Role | Definition | Evidence |
|---|---|---|
| environmental contaminant CHEBI:78298 | Any minor or unwanted substance introduced into the environment that can have undesired effects. | ChEBI |
Alternative labels
174- 1-Methyl-5-phenyl-7-chloro-1,3-dihydro-1H-1,4-benzodiazepin-2-one
- 1-Methyl-5-phenyl-7-chloro-1,3-dihydro-2H-1,4-benzodiazepin-2-one
- 2H-1,4-Benzodiazepin-2-one, 7-chloro-1,3-dihydro-1-methyl-5-phenyl-
- 7-chloro-1,3-dihydro-1-methyl-5-phenyl-2H-1,4-benzodiazepin-2-one
- 7-Chloro-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepine
- 7-Chloro-1-methyl-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
- 7-chloro-1-methyl-5-phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one
- 7-Chloro-1-methyl-5-phenyl-1,3-dihydrobenzo[e][1,4]diazepin-2-one
- 7-Chloro-1-methyl-5-phenyl-1H-1,4-benzodiazepin-2(3H)-one
- 7-Chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2(1H)-one
- 7-Chloro-1-methyl-5-phenyl-3H-1,4-benzodiazepin-2-one
- Alboral
- Aliseum
- Alupram
- Amiprol
- An-Ding
- Anlin
- Ansiolin
- Ansiolisina
- Antenex
- Anxionil
- Apaurin
- Apo-diazepam
- Apozepam
- Apzepam
- Armonil
- Arzepam
- Assival
- Atensine
- Atilen
- Azedipamin
- Baogin
- Benzopin
- Best
- Betapam
- Bialzepam
- Britazepam
- Calmocitene
- Calmod
- Calmpose
- Caudel
- Centrazepam
- Cercine
- Ceregulart
- Chuansuan
- Compaz
- D-Pam
- Desconet
- Desloneg
- Diacepan
- Diaceplex
- Dialag
- Dialar
- Diapam
- Diapax
- Diapine
- Diaquel
- Diastat
- Diatran
- Diazem
- Diazemuls
- Diazepam-Lipuro
- Diazepin
- Dipam
- Dipaz
- Dipezona
- Disopam
- Dizac
- Doval
- Drenian
- Ducene
- Dupin
- Duxen
- DZP
- Elcion CR
- Eridan
- Euphorin
- Euphorin P
- Eurosan
- Evacalm
- Faustan
- Gewacalm
- Gradual
- Gubex
- Hexalid
- Horizon (pharmaceutical)
- Jinpanfan
- Kratium
- Kratium 2
- Lamra
- Lembrol
- Levium
- Libervant
- Lovium
- Mandro
- Mandrozep
- Mentalium
- MeSH ID: D003975
- methyl diazepinone
- Methyldiazepinone
- Methyldiazepinone (pharmaceutical)
- Meval
- Morosan
- Nellium
- Nerozen
- Neurolytril
- Nivalen
- Nixtensyn
- Noan
- Notense
- Novazam
- Ortopsique
- Paceum
- Pacitran
- Pamlin
- Parzam
- Pax
- Paxate
- Paxel
- Paxum
- Placidox 10
- Placidox 2
- Placidox 5
- Plidan
- Pomin
- Propam
- Psychopax
- Q-Pam
- Quievita
- Radizepam
- Relaminal
- Relanium
- Relium
- Reliver
- Ro 5-2807
- Saromet
- Sedapam
- Seduxen
- Servizepam
- Setonil
- Sibazon
- Sibazone
- Simasedan
- Sipam
- Solis
- Sonacon
- Stedon
- Stesolid
- Stesolin
- Tensium
- Tranimul
- Trankinon
- Tranquase
- Tranquil
- Tranquirit
- Tranquo-Puren
- Tranquo-Tablinen
- Trazepam
- Umbrium
- Unisedil
- Valaxona
- Valeo
- Valiquid
- Valitran
- Valium
- Valium Injectable
- Valrelease
- Valtoco
- Vatran
- Vazen
- Vival
- Vivol
- Winii
- Zepaxid
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | AAOVKJBEBIDNHE-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3 |
| IUPAC name chemrof:IUPAC_name | 7-chloro-1,3-dihydro-1-methyl-5-phenyl-2H-1,4-benzodiazepin-2-one |
| Molecular formula chemrof:molecular_formula | C16H13ClN2O |
| Molecular mass chemrof:molecular_mass | 284.746 |
| Monoisotopic mass chemrof:monoisotopic_mass | 284.07164, 284.071641 |
| SMILES string chemrof:smiles_string | CN1C(=O)CN=C(c2ccccc2)c2cc(Cl)ccc21 |
Known URLs
37Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
| Resource | URL | Recorded by |
|---|---|---|
| beilstein | beilstein:754371 | enrich_references.chebi_xrefs |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=439-14-5 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:49575 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.006.476 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID4020406 | enrich_references.pubchem_identifier_url |
| DrugBank | https://go.drugbank.com/drugs/DB00829 | enrich_references.chebi_xrefs |
| drugbank.ca | https://www.drugbank.ca/drugs/DB00829 | enrich_references.pubchem_identifier_url |
| drugcentral | drugcentral:852 | enrich_references.chebi_xrefs |
| drugcentral.org | https://drugcentral.org/drugcard/852 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=169897 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=77518 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL12 | enrich_references.pubchem_identifier_url |
| gmelin | gmelin:124061 | enrich_references.chebi_xrefs |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/Q3JTX2Q7TU | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0014967 | enrich_references.chebi_xrefs |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.044C | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C06948 | enrich_references.chebi_xrefs |
| KEGG | https://www.genome.jp/entry/D00293 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C06948 | enrich_references.pubchem_identifier_url |
| kegg.jp | https://www.kegg.jp/entry/D00293 | enrich_references.pubchem_identifier_url |
| lincs.smallmolecule | lincs.smallmolecule:LSM-2359 | enrich_references.chebi_xrefs |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=43117 | enrich_references.pubchem_identifier_url |
| ncithesaurus.nci.nih.gov | https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C28982 | enrich_references.pubchem_identifier_url |
| pdb-ccd | pdb-ccd:DZP | enrich_references.chebi_xrefs |
| pharmgkb.org | https://www.pharmgkb.org/chemical/PA449283 | enrich_references.pubchem_identifier_url |
| pharos.nih.gov | https://pharos.nih.gov/ligands/KHA18H7FF2WX | enrich_references.pubchem_identifier_url |
| platform.opentargets.org | https://platform.opentargets.org/drug/CHEMBL12 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/3016 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=001617 | enrich_references.pubchem_identifier_url |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/11925051 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/16365514 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/16780966 | enrich_references.chebi_xrefs |
| reaxys | reaxys:754371 | enrich_references.chebi_xrefs |
| rxnav.nlm.nih.gov | https://rxnav.nlm.nih.gov/id/rxnorm/3322 | enrich_references.pubchem_identifier_url |
| vsdb | vsdb:2972 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q210402 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Diazepam | enrich_references.chebi_xrefs |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| f40e1966-0ee1-4de1-92bd-25bb132ff5ae | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 0 |
| c5b8b047-8fd6-4847-a287-a731aac61b2b | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 0 |
| 617e4f0c-8e1b-41cb-a014-b022957e6950 | Environmental → Air → Indoor | EF 3.1 | kg | 0 |
| 7292bd9f-afb7-4b58-9b2b-0e15fbab5289 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 8d0dd8ad-9e4c-4d20-bd28-9bd1359948c9 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 0 |
| afc9fecb-47cc-42de-ab8e-0750903287c8 | Environmental → Air → Unknown | EF 3.1 | kg | 0 |
| f7358e76-09f8-4436-b80b-7eb98042b399 | Environmental → Ground → Agricultural | EF 3.1 | kg | 0 |
| e4c753cc-6880-4695-9be5-c5f9bbaf9b43 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 0 |
| 61e19c78-a596-4fe9-a65e-acbd6a646b7a | Environmental → Ground → Unknown | EF 3.1 | kg | 0 |
| f737edfa-6ca4-4a97-9619-fc8c4f423915 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| fbbfbeee-cf4f-438c-b046-8e33b65a5029 | Environmental → Water → Ocean | EF 3.1 | kg | 0 |
| ee55d294-75a4-497a-a561-da59838d1aa9 | Environmental → Water → Surface water | EF 3.1 | kg | 0 |
| 55de249a-7516-4721-95e2-bf47bd027887 | Environmental → Water → Unknown | EF 3.1 | kg | 0 |
History
Everything that changed this substance (57 changes)
Full record
Flow object JSON
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{
"@value": "Aliseum",
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},
{
"@value": "Alupram",
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},
{
"@value": "Amiprol",
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},
{
"@value": "An-Ding",
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},
{
"@value": "Anlin",
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},
{
"@value": "Ansiolin",
"@language": "en",
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"provenance": {
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},
{
"@value": "Ansiolisina",
"@language": "en",
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}
},
{
"@value": "Antenex",
"@language": "en",
"@lang": "en",
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],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Anxionil",
"@language": "en",
"@lang": "en",
"provenance": {
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"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Apaurin",
"@language": "en",
"@lang": "en",
"provenance": {
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"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Apo-diazepam",
"@language": "en",
"@lang": "en",
"provenance": {
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"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Apozepam",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "brightway-flows",
"prov:hadPrimarySource": [
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}Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works