N-methyl-N-(3-methylphenyl)-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-methyl-N-(3-methylphenyl)-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
N-methyl-N-(3-methylphenyl)-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide
Compound characteristics
Compound ID: | C849-0486 |
Compound Name: | N-methyl-N-(3-methylphenyl)-12-oxo-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline-3-carboxamide |
Molecular Weight: | 361.44 |
Molecular Formula: | C22 H23 N3 O2 |
Smiles: | Cc1cccc(c1)N(C)C(c1ccc2C(N3CCCCCC3=Nc2c1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.0603 |
logD: | 3.0603 |
logSw: | -3.3254 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 42.089 |
InChI Key: | KAGNMRQVNQVZSB-UHFFFAOYSA-N |