4-chloro-N-(3,4-dimethoxybenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)benzamide
Chemical Structure Depiction of
4-chloro-N-(3,4-dimethoxybenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)benzamide
4-chloro-N-(3,4-dimethoxybenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)benzamide
Compound characteristics
| Compound ID: | 6807-0426 |
| Compound Name: | 4-chloro-N-(3,4-dimethoxybenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)benzamide |
| Molecular Weight: | 505.95 |
| Molecular Formula: | C22 H16 Cl N O7 S2 |
| Smiles: | COc1ccc(cc1OC)S(N(C(c1ccc(cc1)[Cl])=O)c1ccc2c(c1)SC(=O)O2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0911 |
| logD: | 4.0911 |
| logSw: | -4.7234 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 82.879 |
| InChI Key: | BPUSAGJPHUIZQV-UHFFFAOYSA-N |