clorazepate

Ligand id: 7548

Name: clorazepate

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 78.76
Molecular weight 314.05
XLogP 4.33
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (source: FDA (1972))
IUPAC Name
7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepine-3-carboxylic acid
International Nonproprietary Names
INN number INN
2224 dipotassium clorazepate
Synonyms
4306 CB
Tranxene®
Database Links
CAS Registry No. 23887-31-2
ChEBI CHEBI:3761
ChEMBL Ligand CHEMBL1213252
DrugBank Ligand DB00628
PubChem CID 2809
Search Google for chemical match using the InChIKey XDDJGVMJFWAHJX-UHFFFAOYSA-N
Search Google for chemicals with the same backbone XDDJGVMJFWAHJX
Search PubMed clinical trials dipotassium clorazepate
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Wikipedia Clorazepate
Comments
The marketed formulation is a racemic mixture of stereo-isomers; R-clorazepate and S-clorazepate. We show the non-isomeric molecule to represent this mixture.