7-{[acetyl(4-methylphenyl)amino]methyl}-N-propyl-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
7-{[acetyl(4-methylphenyl)amino]methyl}-N-propyl-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
7-{[acetyl(4-methylphenyl)amino]methyl}-N-propyl-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | L755-0342 |
| Compound Name: | 7-{[acetyl(4-methylphenyl)amino]methyl}-N-propyl-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide |
| Molecular Weight: | 395.5 |
| Molecular Formula: | C23 H29 N3 O3 |
| Smiles: | CCCNC(N1CCOc2ccc(CN(C(C)=O)c3ccc(C)cc3)cc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9917 |
| logD: | 3.9917 |
| logSw: | -3.8971 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.177 |
| InChI Key: | ZNNUWGVGXZJIJS-UHFFFAOYSA-N |