dimethyl 5-{[1-(4-methylbenzene-1-sulfonyl)cyclopropane-1-carbonyl]amino}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{[1-(4-methylbenzene-1-sulfonyl)cyclopropane-1-carbonyl]amino}benzene-1,3-dicarboxylate
dimethyl 5-{[1-(4-methylbenzene-1-sulfonyl)cyclopropane-1-carbonyl]amino}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | C256-0710 |
| Compound Name: | dimethyl 5-{[1-(4-methylbenzene-1-sulfonyl)cyclopropane-1-carbonyl]amino}benzene-1,3-dicarboxylate |
| Molecular Weight: | 431.46 |
| Molecular Formula: | C21 H21 N O7 S |
| Smiles: | Cc1ccc(cc1)S(C1(CC1)C(Nc1cc(cc(c1)C(=O)OC)C(=O)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4988 |
| logD: | 3.4986 |
| logSw: | -3.6839 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.701 |
| InChI Key: | BSIQZUGUKMJMEQ-UHFFFAOYSA-N |