methyl 4-{[2,6-dimethyl-4-(1,1,3-trioxo-1lambda~6~,2-thiazolidin-2-yl)benzene-1-sulfonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[2,6-dimethyl-4-(1,1,3-trioxo-1lambda~6~,2-thiazolidin-2-yl)benzene-1-sulfonyl]amino}benzoate
methyl 4-{[2,6-dimethyl-4-(1,1,3-trioxo-1lambda~6~,2-thiazolidin-2-yl)benzene-1-sulfonyl]amino}benzoate
Compound characteristics
| Compound ID: | D445-0410 |
| Compound Name: | methyl 4-{[2,6-dimethyl-4-(1,1,3-trioxo-1lambda~6~,2-thiazolidin-2-yl)benzene-1-sulfonyl]amino}benzoate |
| Molecular Weight: | 452.5 |
| Molecular Formula: | C19 H20 N2 O7 S2 |
| Smiles: | Cc1cc(cc(C)c1S(Nc1ccc(cc1)C(=O)OC)(=O)=O)N1C(CCS1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4322 |
| logD: | 1.5553 |
| logSw: | -2.8455 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 107.479 |
| InChI Key: | JXUMSNHRFLJJRH-UHFFFAOYSA-N |