2-fluorophenyl 5-chloro-2-{[(4-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxylate
Chemical Structure Depiction of
2-fluorophenyl 5-chloro-2-{[(4-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxylate
2-fluorophenyl 5-chloro-2-{[(4-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxylate
Compound characteristics
| Compound ID: | D233-0116 |
| Compound Name: | 2-fluorophenyl 5-chloro-2-{[(4-methylphenyl)methyl]sulfanyl}pyrimidine-4-carboxylate |
| Molecular Weight: | 388.85 |
| Molecular Formula: | C19 H14 Cl F N2 O2 S |
| Smiles: | Cc1ccc(CSc2ncc(c(C(=O)Oc3ccccc3F)n2)[Cl])cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1068 |
| logD: | 5.1068 |
| logSw: | -5.5015 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.017 |
| InChI Key: | OYJZKBLQNHWUSX-UHFFFAOYSA-N |