4-({[4-(4-ethylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-4-yl)methyl]benzamide
Chemical Structure Depiction of
4-({[4-(4-ethylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-4-yl)methyl]benzamide
4-({[4-(4-ethylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-4-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V025-2014 |
| Compound Name: | 4-({[4-(4-ethylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-4-yl)methyl]benzamide |
| Molecular Weight: | 516.59 |
| Molecular Formula: | C25 H27 F3 N6 O S |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)c1cc(C(F)(F)F)nc(n1)SCc1ccc(cc1)C(NCc1ccncc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5722 |
| logD: | 2.8848 |
| logSw: | -3.6987 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.554 |
| InChI Key: | PNVBDBYSSJOORQ-UHFFFAOYSA-N |