N-benzyl-7-[(cyclopropanecarbonyl)amino]-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
N-benzyl-7-[(cyclopropanecarbonyl)amino]-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
N-benzyl-7-[(cyclopropanecarbonyl)amino]-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | S555-1671 |
| Compound Name: | N-benzyl-7-[(cyclopropanecarbonyl)amino]-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide |
| Molecular Weight: | 365.43 |
| Molecular Formula: | C21 H23 N3 O3 |
| Smiles: | C1CC1C(Nc1ccc2c(CN(CCO2)C(NCc2ccccc2)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8116 |
| logD: | 2.8116 |
| logSw: | -3.3513 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.588 |
| InChI Key: | NPUHOYLQMVVRDT-UHFFFAOYSA-N |