Basic information
- Standard SMILES
CC#Cc1ncn2c1CN(C)C(=O)c1c(Cl)cccc1-2- InChIKey
MGWQSZRZJDZADX-UHFFFAOYSA-N- Molecular formula
- C15H12ClN3O
- Average molar mass
- 285.73 g/mol
Names & identifiers
- Preferred name
- 7-chloro-4,5-dihydro-5-methyl-3-(1-propynyl)-6H-imidazo[1,5-a][1,4]benzodiazepin-6-one
- IUPAC
- 7-chloro-5-methyl-3-prop-1-ynyl-4H-imidazo[1,5-a][1,4]benzodiazepin-6-one
Names & synonyms
SCHEMBL9669365MGWQSZRZJDZADX-UHFFFAOYSA-N7-chloro-4,5-dihydro-5-methyl-3-(1-propynyl)-6H-imidazo[1,5-a][1,4]benzodiazepin-6-one
Database identifiers
- PubChem CID
- 19851568
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 468
Related reactions
2 records
Compound notes
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