8-Chloro-2-methyl-5,6-dihydro-4-oxo-6-phenyl-4H-pyrazolo[1,5-a][1,4]benzodiazepine

HCID 12377892
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1cc2n(n1)-c1ccc(Cl)cc1C(c1ccccc1)NC2=O
InChIKey
MWYJRFHZGHGPQS-UHFFFAOYSA-N
Molecular formula
C18H14ClN3O
Average molar mass
323.8 g/mol

Names & identifiers

Preferred name
8-Chloro-2-methyl-5,6-dihydro-4-oxo-6-phenyl-4H-pyrazolo[1,5-a][1,4]benzodiazepine
IUPAC
8-chloro-2-methyl-6-phenyl-5,6-dihydropyrazolo[1,5-a][1,4]benzodiazepin-4-one

Names & synonyms

SCHEMBL11526796MWYJRFHZGHGPQS-UHFFFAOYSA-N8-Chloro-2-methyl-5,6-dihydro-4-oxo-6-phenyl-4H-pyrazolo[1,5-a][1,4]benzodiazepine

Database identifiers

PubChem CID
12377892

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
46.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
23

Related reactions

7 records
New reaction record

Linked notes

Loading…