3-[4-(benzenesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-cyclopropylpropanamide
Chemical Structure Depiction of
3-[4-(benzenesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-cyclopropylpropanamide
3-[4-(benzenesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-cyclopropylpropanamide
Compound characteristics
| Compound ID: | S629-1884 |
| Compound Name: | 3-[4-(benzenesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-cyclopropylpropanamide |
| Molecular Weight: | 400.5 |
| Molecular Formula: | C21 H24 N2 O4 S |
| Smiles: | C(Cc1ccc2c(CN(CCO2)S(c2ccccc2)(=O)=O)c1)C(NC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8274 |
| logD: | 2.8274 |
| logSw: | -3.5112 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.15 |
| InChI Key: | SHMPNQZNCFZDRY-UHFFFAOYSA-N |