N-(3,4-dimethoxybenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)pentanamide
Chemical Structure Depiction of
N-(3,4-dimethoxybenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)pentanamide
N-(3,4-dimethoxybenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)pentanamide
Compound characteristics
| Compound ID: | 7202-3498 |
| Compound Name: | N-(3,4-dimethoxybenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)pentanamide |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C20 H21 N O7 S2 |
| Smiles: | CCCCC(N(c1ccc2c(c1)SC(=O)O2)S(c1ccc(c(c1)OC)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4377 |
| logD: | 3.4377 |
| logSw: | -3.8898 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 82.623 |
| InChI Key: | IDVUTXYIPQNPMP-UHFFFAOYSA-N |