quazepam   Click here for help

GtoPdb Ligand ID: 7288

Synonyms: Doral® | SCH-16134
Approved drug
quazepam is an approved drug (FDA (1985))
Compound class: Synthetic organic
Comment: Quazepam is a benzodiazepine drug with hypnotic and anticonvulsant properties [1].
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 3
Topological polar surface area 47.69
Molecular weight 386.03
XLogP 5.56
No. Lipinski's rules broken 1
SMILES / InChI / InChIKey
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Canonical SMILES Clc1ccc2c(c1)C(=NCC(=S)N2CC(F)(F)F)c1ccccc1F
Isomeric SMILES Clc1ccc2c(c1)C(=NCC(=S)N2CC(F)(F)F)c1ccccc1F
InChI InChI=1S/C17H11ClF4N2S/c18-10-5-6-14-12(7-10)16(11-3-1-2-4-13(11)19)23-8-15(25)24(14)9-17(20,21)22/h1-7H,8-9H2
InChI Key IKMPWMZBZSAONZ-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (1985))
IUPAC Name Click here for help
7-chloro-5-(2-fluorophenyl)-1-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-1,4-benzodiazepine-2-thione
International Nonproprietary Names Click here for help
INN number INN
4018 quazepam
Synonyms Click here for help
Doral® | SCH-16134
Database Links Click here for help
CAS Registry No. 36735-22-5
ChEMBL Ligand CHEMBL1200472
DrugBank Ligand DB01589
DrugCentral Ligand 2336
GtoPdb PubChem SID 178103862
PubChem CID 4999
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Wikipedia Quazepam