Prazepam
fo-2a4ab9a3575c9340
Identity
- Type
- Neutral molecule
- CAS
- 2955-38-6
- EC
- 220-975-8
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 56 across every transformer
Structure
Alternative labels
14- 1-(Cyclopropylmethyl)-5-phenyl-7-chloro-1,3-dihydro-2H-1,4-benzodiazepin-2-one
- 1-Cyclopropylmethyl-5-phenyl-7-chloro-1H-1,4-benzodiazepin-2(3H)-one
- 2H-1,4-Benzodiazepin-2-one, 7-chloro-1-(cyclopropylmethyl)-1,3-dihydro-5-phenyl-
- 7-Chloro-1-(cyclopropylmethyl)-1,3-dihydro-5-phenyl-2H-1,4-benzodiazepin-2-one
- 7-Chloro-1-(cyclopropylmethyl)-5-phenyl-1H-1,4-benzodiazepin-2(3H)-one
- Centrax
- Demetrin
- Lysanxia
- MeSH ID: D011222
- prazene
- sedapran
- Settima
- trepidan
- verstran
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | MWQCHHACWWAQLJ-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C19H17ClN2O/c20-15-8-9-17-16(10-15)19(14-4-2-1-3-5-14)21-11-18(23)22(17)12-13-6-7-13/h1-5,8-10,13H,6-7,11-12H2 |
| IUPAC name chemrof:IUPAC_name | 1-(Cyclopropylmethyl)-5-phenyl-7-chloro-1,3-dihydro-2H-1,4-benzodiazepin-2-one |
| Molecular formula chemrof:molecular_formula | C19H17ClN2O |
| Molecular mass chemrof:molecular_mass | 324.811 |
| Monoisotopic mass chemrof:monoisotopic_mass | 324.10294, 324.102941 |
| SMILES string chemrof:smiles_string | O=C1CN=C(c2ccccc2)c2cc(Cl)ccc2N1CC1CC1 |
Known URLs
24Where 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 |
|---|---|---|
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=2955-38-6 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:8362 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.019.069 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID4021181 | enrich_references.pubchem_identifier_url |
| drugbank.ca | https://www.drugbank.ca/drugs/DB01588 | enrich_references.pubchem_identifier_url |
| drugcentral | drugcentral:2240 | enrich_references.chebi_xrefs |
| drugcentral.org | https://drugcentral.org/drugcard/2240 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=277179 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL969 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/Q30VCC064M | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0015527 | enrich_references.chebi_xrefs |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J3.397I | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C07366 | enrich_references.chebi_xrefs |
| KEGG | https://www.genome.jp/entry/D00470 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C07366 | enrich_references.pubchem_identifier_url |
| kegg.jp | https://www.kegg.jp/entry/D00470 | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=43579 | enrich_references.pubchem_identifier_url |
| ncithesaurus.nci.nih.gov | https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C66458 | enrich_references.pubchem_identifier_url |
| pharmgkb.org | https://www.pharmgkb.org/chemical/PA164776668 | enrich_references.pubchem_identifier_url |
| pharos.nih.gov | https://pharos.nih.gov/ligands/7WK1AMSTSPVN | enrich_references.pubchem_identifier_url |
| platform.opentargets.org | https://platform.opentargets.org/drug/CHEMBL969 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/4890 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q2149443 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Prazepam | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 15f7f6fa-5160-457f-8b03-a6e52bea8de9 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 0 |
| 86eefcd9-442f-45d5-b9e8-ced0169cddc2 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 0 |
| 7a91de3f-6ed6-430f-a027-c56a819f6ad8 | Environmental → Air → Indoor | EF 3.1 | kg | 0 |
| 7f75d087-0c94-4b20-a8cb-3f7cf162e455 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 9bb050e3-b99e-470c-b42b-8a5c99a3561f | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 0 |
| f6d986e8-951d-42f9-ae3b-4d9f8d2440e9 | Environmental → Air → Unknown | EF 3.1 | kg | 0 |
| 19e37b52-ad83-4f4e-8966-b2ee7a2f2ab7 | Environmental → Ground → Agricultural | EF 3.1 | kg | 0 |
| c7fa08d7-3dd6-4293-80e1-48647e57efd1 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 0 |
| a0bb771c-d048-4992-bdf3-537b9f647d52 | Environmental → Ground → Unknown | EF 3.1 | kg | 0 |
| 31075524-c7b9-4ca0-8a3b-bc4517766048 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| f136cf83-b460-46b8-a5d4-11ab418f31f6 | Environmental → Water → Ocean | EF 3.1 | kg | 0 |
| a1cadc2b-950d-4921-b545-21dd6f6ab78c | Environmental → Water → Surface water | EF 3.1 | kg | 0 |
| 497f6c6f-b72d-49f4-aa65-2774207ffcd4 | Environmental → Water → Unknown | EF 3.1 | kg | 0 |
History
Everything that changed this substance (56 changes)
Full record
Flow object JSON
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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