N-{3-[(3S)-3-methyl-7-(pyridin-3-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carbonyl]phenyl}acetamide
Chemical Structure Depiction of
N-{3-[(3S)-3-methyl-7-(pyridin-3-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carbonyl]phenyl}acetamide
N-{3-[(3S)-3-methyl-7-(pyridin-3-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carbonyl]phenyl}acetamide
Compound characteristics
| Compound ID: | SC09-0553 |
| Compound Name: | N-{3-[(3S)-3-methyl-7-(pyridin-3-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carbonyl]phenyl}acetamide |
| Molecular Weight: | 401.46 |
| Molecular Formula: | C24 H23 N3 O3 |
| Smiles: | CC(Nc1cccc(c1)C(N1Cc2cc(ccc2OC[C@@H]1C)c1cccnc1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.4236 |
| logD: | 3.4167 |
| logSw: | -3.3233 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.122 |
| InChI Key: | RUCRIRIRPLZFLT-INIZCTEOSA-N |