N-(3,4-dimethylphenyl)-N,3-dimethyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-N,3-dimethyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
N-(3,4-dimethylphenyl)-N,3-dimethyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G008-3349 |
| Compound Name: | N-(3,4-dimethylphenyl)-N,3-dimethyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 390.52 |
| Molecular Formula: | C19 H22 N2 O3 S2 |
| Smiles: | CC1CSc2ccc(cc2NC1=O)S(N(C)c1ccc(C)c(C)c1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5636 |
| logD: | 4.5632 |
| logSw: | -4.2817 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.268 |
| InChI Key: | IXAOPPCLTVUIFK-CQSZACIVSA-N |