N-(4-{[(3-methylphenyl)methyl]carbamoyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Chemical Structure Depiction of
N-(4-{[(3-methylphenyl)methyl]carbamoyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
N-(4-{[(3-methylphenyl)methyl]carbamoyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide
Compound characteristics
| Compound ID: | G217-0080 |
| Compound Name: | N-(4-{[(3-methylphenyl)methyl]carbamoyl}phenyl)-2,3,4,5-tetrahydro-1H-1-benzazepine-1-carboxamide |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C26 H27 N3 O2 |
| Smiles: | Cc1cccc(CNC(c2ccc(cc2)NC(N2CCCCc3ccccc23)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.551 |
| logD: | 5.5509 |
| logSw: | -5.2815 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.116 |
| InChI Key: | XAYSKGLMPKGECP-UHFFFAOYSA-N |