N-(3,4-dimethoxyphenyl)-3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
N-(3,4-dimethoxyphenyl)-3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G008-1662 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 408.49 |
| Molecular Formula: | C18 H20 N2 O5 S2 |
| Smiles: | CC1CSc2ccc(cc2NC1=O)S(Nc1ccc(c(c1)OC)OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6143 |
| logD: | 2.2787 |
| logSw: | -3.1988 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.357 |
| InChI Key: | TVXLDWYSYGXGSM-LLVKDONJSA-N |