2-methylphenyl 5-chloro-2-(phenylmethanesulfonyl)pyrimidine-4-carboxylate
Chemical Structure Depiction of
2-methylphenyl 5-chloro-2-(phenylmethanesulfonyl)pyrimidine-4-carboxylate
2-methylphenyl 5-chloro-2-(phenylmethanesulfonyl)pyrimidine-4-carboxylate
Compound characteristics
| Compound ID: | D650-0073 |
| Compound Name: | 2-methylphenyl 5-chloro-2-(phenylmethanesulfonyl)pyrimidine-4-carboxylate |
| Molecular Weight: | 402.85 |
| Molecular Formula: | C19 H15 Cl N2 O4 S |
| Smiles: | Cc1ccccc1OC(c1c(cnc(n1)S(Cc1ccccc1)(=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6717 |
| logD: | 3.6717 |
| logSw: | -4.0175 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.881 |
| InChI Key: | BYSKHMXUCDLYER-UHFFFAOYSA-N |