N,3-dimethyl-N-(4-methylphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
N,3-dimethyl-N-(4-methylphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
N,3-dimethyl-N-(4-methylphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G008-1821 |
| Compound Name: | N,3-dimethyl-N-(4-methylphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 376.49 |
| Molecular Formula: | C18 H20 N2 O3 S2 |
| Smiles: | CC1CSc2ccc(cc2NC1=O)S(N(C)c1ccc(C)cc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8755 |
| logD: | 3.8751 |
| logSw: | -3.8182 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.268 |
| InChI Key: | NJSVNOQLSQVWIC-CYBMUJFWSA-N |