N-(2-cyanophenyl)-2-({6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(2-cyanophenyl)-2-({6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)acetamide
N-(2-cyanophenyl)-2-({6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | M179-2967 |
| Compound Name: | N-(2-cyanophenyl)-2-({6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)acetamide |
| Molecular Weight: | 448.52 |
| Molecular Formula: | C23 H21 F N6 O S |
| Smiles: | C1CN(CCN1c1ccccc1F)c1cc(ncn1)SCC(Nc1ccccc1C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0693 |
| logD: | 4.0682 |
| logSw: | -4.2097 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.521 |
| InChI Key: | CYXYRGMQDQWIEL-UHFFFAOYSA-N |