4-[4-(ethanesulfonyl)piperazin-1-yl]-6-ethyl-2-methyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
Chemical Structure Depiction of
4-[4-(ethanesulfonyl)piperazin-1-yl]-6-ethyl-2-methyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
4-[4-(ethanesulfonyl)piperazin-1-yl]-6-ethyl-2-methyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
Compound characteristics
| Compound ID: | V004-1873 |
| Compound Name: | 4-[4-(ethanesulfonyl)piperazin-1-yl]-6-ethyl-2-methyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine |
| Molecular Weight: | 456.53 |
| Molecular Formula: | C21 H27 F3 N4 O2 S |
| Salt: | not_available |
| Smiles: | CCc1c(Cc2cccc(c2)C(F)(F)F)c(nc(C)n1)N1CCN(CC1)S(CC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3359 |
| logD: | 4.2262 |
| logSw: | -4.4656 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.487 |
| InChI Key: | FLYPMLIOPXZEQA-UHFFFAOYSA-N |