4-fluorophenyl 5-chloro-2-(ethylsulfanyl)pyrimidine-4-carboxylate
Chemical Structure Depiction of
4-fluorophenyl 5-chloro-2-(ethylsulfanyl)pyrimidine-4-carboxylate
4-fluorophenyl 5-chloro-2-(ethylsulfanyl)pyrimidine-4-carboxylate
Compound characteristics
| Compound ID: | D054-0137 |
| Compound Name: | 4-fluorophenyl 5-chloro-2-(ethylsulfanyl)pyrimidine-4-carboxylate |
| Molecular Weight: | 312.75 |
| Molecular Formula: | C13 H10 Cl F N2 O2 S |
| Smiles: | CCSc1ncc(c(C(=O)Oc2ccc(cc2)F)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.8518 |
| logD: | 3.8518 |
| logSw: | -4.1675 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.202 |
| InChI Key: | LGMRWBBETCWXLS-UHFFFAOYSA-N |