7-[(cyclopropanecarbonyl)amino]-N-[(4-methylphenyl)methyl]-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
7-[(cyclopropanecarbonyl)amino]-N-[(4-methylphenyl)methyl]-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
7-[(cyclopropanecarbonyl)amino]-N-[(4-methylphenyl)methyl]-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | S555-1679 |
| Compound Name: | 7-[(cyclopropanecarbonyl)amino]-N-[(4-methylphenyl)methyl]-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide |
| Molecular Weight: | 379.46 |
| Molecular Formula: | C22 H25 N3 O3 |
| Smiles: | Cc1ccc(CNC(N2CCOc3ccc(cc3C2)NC(C2CC2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.235 |
| logD: | 3.235 |
| logSw: | -3.1761 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.588 |
| InChI Key: | WXBGDVGRYBQREA-UHFFFAOYSA-N |