N-benzyl-4-[(pyridin-4-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Chemical Structure Depiction of
N-benzyl-4-[(pyridin-4-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
N-benzyl-4-[(pyridin-4-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Compound characteristics
| Compound ID: | M400-0264 |
| Compound Name: | N-benzyl-4-[(pyridin-4-yl)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide |
| Molecular Weight: | 401.46 |
| Molecular Formula: | C24 H23 N3 O3 |
| Smiles: | C(C(N1CCOc2ccc(cc2C1)C(NCc1ccccc1)=O)=O)c1ccncc1 |
| Stereo: | ACHIRAL |
| logP: | 2.4549 |
| logD: | 2.4422 |
| logSw: | -2.8507 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.145 |
| InChI Key: | RAAJLCLNOXCVRF-UHFFFAOYSA-N |