dimethyl 2-{[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-{[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}benzene-1,4-dicarboxylate
dimethyl 2-{[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}benzene-1,4-dicarboxylate
Compound characteristics
Compound ID: | 3966-2214 |
Compound Name: | dimethyl 2-{[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}benzene-1,4-dicarboxylate |
Molecular Weight: | 463.27 |
Molecular Formula: | C21 H16 Cl2 N2 O6 |
Smiles: | Cc1c(C(Nc2cc(ccc2C(=O)OC)C(=O)OC)=O)c(c2c(cccc2[Cl])[Cl])no1 |
Stereo: | ACHIRAL |
logP: | 4.1761 |
logD: | 2.4122 |
logSw: | -4.7456 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 86.94 |
InChI Key: | NKEDRCXZLOPLLU-UHFFFAOYSA-N |