4-chlorophenyl 5-chloro-2-(ethanesulfonyl)pyrimidine-4-carboxylate
Chemical Structure Depiction of
4-chlorophenyl 5-chloro-2-(ethanesulfonyl)pyrimidine-4-carboxylate
4-chlorophenyl 5-chloro-2-(ethanesulfonyl)pyrimidine-4-carboxylate
Compound characteristics
| Compound ID: | D491-0169 |
| Compound Name: | 4-chlorophenyl 5-chloro-2-(ethanesulfonyl)pyrimidine-4-carboxylate |
| Molecular Weight: | 361.2 |
| Molecular Formula: | C13 H10 Cl2 N2 O4 S |
| Smiles: | CCS(c1ncc(c(C(=O)Oc2ccc(cc2)[Cl])n1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0002 |
| logD: | 3.0002 |
| logSw: | -3.5658 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.065 |
| InChI Key: | KOVSCUIAHZDPLA-UHFFFAOYSA-N |