N-ethyl-4-oxo-N-phenyl-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
N-ethyl-4-oxo-N-phenyl-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
N-ethyl-4-oxo-N-phenyl-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | E975-1505 |
| Compound Name: | N-ethyl-4-oxo-N-phenyl-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 362.47 |
| Molecular Formula: | C17 H18 N2 O3 S2 |
| Smiles: | CCN(c1ccccc1)S(c1ccc2c(c1)NC(CCS2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7561 |
| logD: | 2.7559 |
| logSw: | -3.4148 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.94 |
| InChI Key: | KQCBCXWNLWBMEF-UHFFFAOYSA-N |