4-oxo-N-[2-(thiophen-2-yl)ethyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
4-oxo-N-[2-(thiophen-2-yl)ethyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
4-oxo-N-[2-(thiophen-2-yl)ethyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | E975-1657 |
| Compound Name: | 4-oxo-N-[2-(thiophen-2-yl)ethyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 368.49 |
| Molecular Formula: | C15 H16 N2 O3 S3 |
| Smiles: | C1CSc2ccc(cc2NC1=O)S(NCCc1cccs1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5196 |
| logD: | 2.5193 |
| logSw: | -3.0118 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.008 |
| InChI Key: | DIOPAWAGEHFKNN-UHFFFAOYSA-N |