2-cyclopropyl-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-ethyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
Chemical Structure Depiction of
2-cyclopropyl-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-ethyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
2-cyclopropyl-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-ethyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
Compound characteristics
| Compound ID: | V005-4487 |
| Compound Name: | 2-cyclopropyl-4-[4-(ethanesulfonyl)piperazin-1-yl]-6-ethyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine |
| Molecular Weight: | 482.57 |
| Molecular Formula: | C23 H29 F3 N4 O2 S |
| Smiles: | CCc1c(Cc2cccc(c2)C(F)(F)F)c(nc(C2CC2)n1)N1CCN(CC1)S(CC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2481 |
| logD: | 4.1619 |
| logSw: | -5.3035 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.125 |
| InChI Key: | XLGRLINCUCUBOA-UHFFFAOYSA-N |