4-ethyl-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-2-(propan-2-yl)-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
Chemical Structure Depiction of
4-ethyl-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-2-(propan-2-yl)-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
4-ethyl-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-2-(propan-2-yl)-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
Compound characteristics
| Compound ID: | V029-4990 |
| Compound Name: | 4-ethyl-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-2-(propan-2-yl)-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine |
| Molecular Weight: | 498.61 |
| Molecular Formula: | C24 H33 F3 N4 O2 S |
| Salt: | not_available |
| Smiles: | CCCS(N1CCN(CC1)c1c(Cc2cccc(c2)C(F)(F)F)c(CC)nc(C(C)C)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6926 |
| logD: | 5.5285 |
| logSw: | -5.6384 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.874 |
| InChI Key: | UDUQCEDXZYDZCC-UHFFFAOYSA-N |