N-(butan-2-yl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
N-(butan-2-yl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
N-(butan-2-yl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | E975-1482 |
| Compound Name: | N-(butan-2-yl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 314.42 |
| Molecular Formula: | C13 H18 N2 O3 S2 |
| Smiles: | CCC(C)NS(c1ccc2c(c1)NC(CCS2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0887 |
| logD: | 2.0885 |
| logSw: | -2.966 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.075 |
| InChI Key: | FXBYBQIMODYXKT-VIFPVBQESA-N |