N-cyclopropyl-3-[4-(2,5-dimethoxybenzene-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Chemical Structure Depiction of
N-cyclopropyl-3-[4-(2,5-dimethoxybenzene-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
N-cyclopropyl-3-[4-(2,5-dimethoxybenzene-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Compound characteristics
| Compound ID: | S629-1892 |
| Compound Name: | N-cyclopropyl-3-[4-(2,5-dimethoxybenzene-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C23 H28 N2 O6 S |
| Smiles: | COc1ccc(c(c1)S(N1CCOc2ccc(CCC(NC3CC3)=O)cc2C1)(=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.8332 |
| logD: | 2.8332 |
| logSw: | -3.5564 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.324 |
| InChI Key: | PFAKPJMSMMLZFB-UHFFFAOYSA-N |