dimethyl 5-{[(4-chlorophenyl)methanesulfonyl]amino}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{[(4-chlorophenyl)methanesulfonyl]amino}benzene-1,3-dicarboxylate
dimethyl 5-{[(4-chlorophenyl)methanesulfonyl]amino}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | Y032-3823 |
| Compound Name: | dimethyl 5-{[(4-chlorophenyl)methanesulfonyl]amino}benzene-1,3-dicarboxylate |
| Molecular Weight: | 397.83 |
| Molecular Formula: | C17 H16 Cl N O6 S |
| Smiles: | COC(c1cc(cc(c1)NS(Cc1ccc(cc1)[Cl])(=O)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.777 |
| logD: | 3.5476 |
| logSw: | -4.2316 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.863 |
| InChI Key: | ZSZMRUBWVAIIKL-UHFFFAOYSA-N |