3,4-dimethylphenyl 5-chloro-2-(ethanesulfonyl)pyrimidine-4-carboxylate
Chemical Structure Depiction of
3,4-dimethylphenyl 5-chloro-2-(ethanesulfonyl)pyrimidine-4-carboxylate
3,4-dimethylphenyl 5-chloro-2-(ethanesulfonyl)pyrimidine-4-carboxylate
Compound characteristics
| Compound ID: | D491-0171 |
| Compound Name: | 3,4-dimethylphenyl 5-chloro-2-(ethanesulfonyl)pyrimidine-4-carboxylate |
| Molecular Weight: | 354.81 |
| Molecular Formula: | C15 H15 Cl N2 O4 S |
| Smiles: | CCS(c1ncc(c(C(=O)Oc2ccc(C)c(C)c2)n1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3558 |
| logD: | 3.3558 |
| logSw: | -3.621 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.065 |
| InChI Key: | FVYPBYUWZXNRLT-UHFFFAOYSA-N |