7-{3-[benzyl(methyl)amino]-3-oxopropyl}-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
7-{3-[benzyl(methyl)amino]-3-oxopropyl}-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
7-{3-[benzyl(methyl)amino]-3-oxopropyl}-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | S629-0935 |
| Compound Name: | 7-{3-[benzyl(methyl)amino]-3-oxopropyl}-N-(propan-2-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide |
| Molecular Weight: | 409.53 |
| Molecular Formula: | C24 H31 N3 O3 |
| Smiles: | CC(C)NC(N1CCOc2ccc(CCC(N(C)Cc3ccccc3)=O)cc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9788 |
| logD: | 3.9788 |
| logSw: | -4.0296 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.843 |
| InChI Key: | ZUQSLHRCGHKERZ-UHFFFAOYSA-N |