4-methylphenyl 5-chloro-2-(methanesulfonyl)pyrimidine-4-carboxylate
Chemical Structure Depiction of
4-methylphenyl 5-chloro-2-(methanesulfonyl)pyrimidine-4-carboxylate
4-methylphenyl 5-chloro-2-(methanesulfonyl)pyrimidine-4-carboxylate
Compound characteristics
| Compound ID: | D491-0146 |
| Compound Name: | 4-methylphenyl 5-chloro-2-(methanesulfonyl)pyrimidine-4-carboxylate |
| Molecular Weight: | 326.76 |
| Molecular Formula: | C13 H11 Cl N2 O4 S |
| Smiles: | Cc1ccc(cc1)OC(c1c(cnc(n1)S(C)(=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.1782 |
| logD: | 2.1782 |
| logSw: | -2.9018 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.778 |
| InChI Key: | LQOGWLHIVUQIQI-UHFFFAOYSA-N |