4-({[4-(4-ethylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide
Chemical Structure Depiction of
4-({[4-(4-ethylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide
4-({[4-(4-ethylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide
Compound characteristics
| Compound ID: | V025-1992 |
| Compound Name: | 4-({[4-(4-ethylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}methyl)-N-(2-methylpropyl)benzamide |
| Molecular Weight: | 481.58 |
| Molecular Formula: | C23 H30 F3 N5 O S |
| Salt: | not_available |
| Smiles: | CCN1CCN(CC1)c1cc(C(F)(F)F)nc(n1)SCc1ccc(cc1)C(NCC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5141 |
| logD: | 3.8266 |
| logSw: | -4.1939 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.398 |
| InChI Key: | WXNJHVZXEPWXBM-UHFFFAOYSA-N |