2-methoxy-N-{4-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}acetamide
Chemical Structure Depiction of
2-methoxy-N-{4-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}acetamide
2-methoxy-N-{4-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}acetamide
Compound characteristics
| Compound ID: | S555-1322 |
| Compound Name: | 2-methoxy-N-{4-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}acetamide |
| Molecular Weight: | 327.38 |
| Molecular Formula: | C18 H21 N3 O3 |
| Smiles: | COCC(Nc1ccc2c(CN(CCO2)Cc2ccccn2)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3572 |
| logD: | 1.0237 |
| logSw: | -2.1561 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.032 |
| InChI Key: | OKQFFXAODQBMES-UHFFFAOYSA-N |