4-chloro-3-methylphenyl 5-chloro-2-[(2-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxylate
Chemical Structure Depiction of
4-chloro-3-methylphenyl 5-chloro-2-[(2-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxylate
4-chloro-3-methylphenyl 5-chloro-2-[(2-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxylate
Compound characteristics
| Compound ID: | D650-0235 |
| Compound Name: | 4-chloro-3-methylphenyl 5-chloro-2-[(2-fluorophenyl)methanesulfonyl]pyrimidine-4-carboxylate |
| Molecular Weight: | 455.29 |
| Molecular Formula: | C19 H13 Cl2 F N2 O4 S |
| Smiles: | Cc1cc(ccc1[Cl])OC(c1c(cnc(n1)S(Cc1ccccc1F)(=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1738 |
| logD: | 5.1738 |
| logSw: | -5.6275 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.794 |
| InChI Key: | JOWKQEHJIQQLHG-UHFFFAOYSA-N |