N-(4-acetamidophenyl)-5-chloro-2-{[(2-fluorophenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
Chemical Structure Depiction of
N-(4-acetamidophenyl)-5-chloro-2-{[(2-fluorophenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
N-(4-acetamidophenyl)-5-chloro-2-{[(2-fluorophenyl)methyl]sulfanyl}pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D233-0210 |
| Compound Name: | N-(4-acetamidophenyl)-5-chloro-2-{[(2-fluorophenyl)methyl]sulfanyl}pyrimidine-4-carboxamide |
| Molecular Weight: | 430.89 |
| Molecular Formula: | C20 H16 Cl F N4 O2 S |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1ccccc1F)[Cl])=O)c1ccc(cc1)NC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3095 |
| logD: | 4.308 |
| logSw: | -4.3246 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.905 |
| InChI Key: | QDRMBYPVHVAIDD-UHFFFAOYSA-N |