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CAS 894-77-9

:

3-Amino-7-chloro-1,3-dihydro-5-phenyl-2H-1,4-benzodiazepin-2-one

Description:
3-Amino-7-chloro-1,3-dihydro-5-phenyl-2H-1,4-benzodiazepin-2-one, with the CAS number 894-77-9, is a chemical compound belonging to the benzodiazepine class. This substance features a benzodiazepine core structure, characterized by a fused benzene and diazepine ring system. The presence of an amino group at the 3-position and a chloro substituent at the 7-position contributes to its unique chemical properties and potential biological activity. The phenyl group at the 5-position enhances its lipophilicity, which may influence its pharmacokinetic profile. This compound is of interest in medicinal chemistry due to its potential applications in the development of anxiolytic, sedative, or anticonvulsant agents. Its structural features suggest that it may interact with the central nervous system, possibly modulating neurotransmitter systems. As with many benzodiazepines, safety and efficacy are critical considerations in its use, and it may be subject to regulatory controls due to its psychoactive properties.
Formula:C15H12ClN3O
InChI:InChI=1S/C15H12ClN3O/c16-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)19-14(17)15(20)18-12/h1-8,14H,17H2,(H,18,20)
InChI key:InChIKey=TUINAAYXMRLCEA-UHFFFAOYSA-N
SMILES:ClC=1C=C2C(=NC(N)C(=O)NC2=CC1)C3=CC=CC=C3
Synonyms:
  • 3-Amino-7-chloro-1,3-dihydro-5-phenyl-2H-1,4-benzodiazepin-2-one
  • 2H-1,4-Benzodiazepin-2-one, 3-amino-7-chloro-1,3-dihydro-5-phenyl-
  • 3-Amino-7-chloro-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
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