dimethyl 5-{[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}benzene-1,3-dicarboxylate
dimethyl 5-{[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | Y031-9201 |
| Compound Name: | dimethyl 5-{[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]amino}benzene-1,3-dicarboxylate |
| Molecular Weight: | 463.27 |
| Molecular Formula: | C21 H16 Cl2 N2 O6 |
| Smiles: | Cc1c(C(Nc2cc(cc(c2)C(=O)OC)C(=O)OC)=O)c(c2c(cccc2[Cl])[Cl])no1 |
| Stereo: | ACHIRAL |
| logP: | 4.6519 |
| logD: | 4.6406 |
| logSw: | -5.0724 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.637 |
| InChI Key: | YDMJFXMOZPBODO-UHFFFAOYSA-N |