5-methyl-2-(propan-2-yl)phenyl 5-chloro-2-(methanesulfonyl)pyrimidine-4-carboxylate
Chemical Structure Depiction of
5-methyl-2-(propan-2-yl)phenyl 5-chloro-2-(methanesulfonyl)pyrimidine-4-carboxylate
5-methyl-2-(propan-2-yl)phenyl 5-chloro-2-(methanesulfonyl)pyrimidine-4-carboxylate
Compound characteristics
| Compound ID: | D491-0153 |
| Compound Name: | 5-methyl-2-(propan-2-yl)phenyl 5-chloro-2-(methanesulfonyl)pyrimidine-4-carboxylate |
| Molecular Weight: | 368.84 |
| Molecular Formula: | C16 H17 Cl N2 O4 S |
| Smiles: | CC(C)c1ccc(C)cc1OC(c1c(cnc(n1)S(C)(=O)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.411 |
| logD: | 3.411 |
| logSw: | -3.8067 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.865 |
| InChI Key: | NNCBZNRLEOHBPT-UHFFFAOYSA-N |