2-methyl-4-oxo-N-[2-(thiophen-2-yl)ethyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
2-methyl-4-oxo-N-[2-(thiophen-2-yl)ethyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
2-methyl-4-oxo-N-[2-(thiophen-2-yl)ethyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G008-1649 |
| Compound Name: | 2-methyl-4-oxo-N-[2-(thiophen-2-yl)ethyl]-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 382.52 |
| Molecular Formula: | C16 H18 N2 O3 S3 |
| Smiles: | CC1CC(Nc2cc(ccc2S1)S(NCCc1cccs1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9603 |
| logD: | 2.9599 |
| logSw: | -3.528 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.008 |
| InChI Key: | BCEQMSXFJXCTEZ-LLVKDONJSA-N |