N-(4-{2-[(1-benzylpiperidin-4-yl)amino]-2-oxoethyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Chemical Structure Depiction of
N-(4-{2-[(1-benzylpiperidin-4-yl)amino]-2-oxoethyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
N-(4-{2-[(1-benzylpiperidin-4-yl)amino]-2-oxoethyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Compound characteristics
| Compound ID: | G217-1098 |
| Compound Name: | N-(4-{2-[(1-benzylpiperidin-4-yl)amino]-2-oxoethyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide |
| Molecular Weight: | 496.65 |
| Molecular Formula: | C31 H36 N4 O2 |
| Smiles: | C1CCN(C(Nc2ccc(CC(NC3CCN(CC3)Cc3ccccc3)=O)cc2)=O)c2ccccc2C1 |
| Stereo: | ACHIRAL |
| logP: | 4.9433 |
| logD: | 3.3856 |
| logSw: | -4.7205 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.169 |
| InChI Key: | BNQLHRFRHZZLIU-UHFFFAOYSA-N |