Basic information
- Standard SMILES
Cc1nc2c(n1C)CCN(C(=O)c1ccc(N)cc1)c1ccccc1-2- InChIKey
PIBJNIPGTVULSY-UHFFFAOYSA-N- Molecular formula
- C20H20N4O
- Average molar mass
- 332.4 g/mol
Names & identifiers
- Preferred name
- 6-(4-Aminobenzoyl)-2,3-dimethyl-3,4,5,6-tetrahydroimidazo[4,5-d][1]benzazepine
- IUPAC
- (4-aminophenyl)-(2,3-dimethyl-4,5-dihydroimidazo[4,5-d][1]benzazepin-6-yl)methanone
Names & synonyms
SCHEMBL6995135PIBJNIPGTVULSY-UHFFFAOYSA-N6-(4-aminobenzoyl)-2,3-dimethyl-3,4,5,6-tetrahydroimidazo[4,5-d][1]benzazepine
Database identifiers
- PubChem CID
- 69955641
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 64.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 490
Related reactions
3 records
Compound notes
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