4-({[4-(4-methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]benzamide
Chemical Structure Depiction of
4-({[4-(4-methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]benzamide
4-({[4-(4-methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V017-5185 |
| Compound Name: | 4-({[4-(4-methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-[(pyridin-3-yl)methyl]benzamide |
| Molecular Weight: | 502.56 |
| Molecular Formula: | C24 H25 F3 N6 O S |
| Salt: | not_available |
| Smiles: | CN1CCN(CC1)c1cc(C(F)(F)F)nc(n1)SCc1ccc(cc1)C(NCc1cccnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3563 |
| logD: | 2.7864 |
| logSw: | -3.4132 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.584 |
| InChI Key: | LKMBVFCCXVATLY-UHFFFAOYSA-N |