N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Chemical Structure Depiction of
N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide
Compound characteristics
| Compound ID: | G008-1462 |
| Compound Name: | N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-methyl-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-7-sulfonamide |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C19 H19 N3 O4 S3 |
| Smiles: | CCOc1ccc2c(c1)sc(NS(c1ccc3c(c1)NC(CC(C)S3)=O)(=O)=O)n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9822 |
| logD: | 3.7495 |
| logSw: | -4.0338 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.925 |
| InChI Key: | ONEFEHGVSHSWSG-LLVKDONJSA-N |