3-[4-(3-methoxybenzene-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Chemical Structure Depiction of
3-[4-(3-methoxybenzene-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
3-[4-(3-methoxybenzene-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Compound characteristics
| Compound ID: | S629-1571 |
| Compound Name: | 3-[4-(3-methoxybenzene-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide |
| Molecular Weight: | 390.46 |
| Molecular Formula: | C19 H22 N2 O5 S |
| Smiles: | COc1cccc(c1)S(N1CCOc2ccc(CCC(N)=O)cc2C1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1724 |
| logD: | 2.1724 |
| logSw: | -2.7329 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.825 |
| InChI Key: | VZYYDTMNTAUHGW-UHFFFAOYSA-N |