N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G008-1700 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 436.55 |
| Molecular Formula: | C20 H24 N2 O5 S2 |
| Smiles: | CC1CSc2ccc(cc2NC1=O)S(NCCc1ccc(c(c1)OC)OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7235 |
| logD: | 2.7231 |
| logSw: | -3.3573 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.308 |
| InChI Key: | LPCDHBCNSUSYHS-CYBMUJFWSA-N |