4-(1-acetylpiperidin-4-yl)-N-[(4-methylphenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Chemical Structure Depiction of
4-(1-acetylpiperidin-4-yl)-N-[(4-methylphenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
4-(1-acetylpiperidin-4-yl)-N-[(4-methylphenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Compound characteristics
| Compound ID: | M400-0214 |
| Compound Name: | 4-(1-acetylpiperidin-4-yl)-N-[(4-methylphenyl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide |
| Molecular Weight: | 421.54 |
| Molecular Formula: | C25 H31 N3 O3 |
| Smiles: | CC(N1CCC(CC1)N1CCOc2ccc(cc2C1)C(NCc1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0602 |
| logD: | 1.6817 |
| logSw: | -3.1493 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.077 |
| InChI Key: | BMPYCVVZABRKNX-UHFFFAOYSA-N |