4-(methoxymethyl)-2-phenyl-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
Chemical Structure Depiction of
4-(methoxymethyl)-2-phenyl-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
4-(methoxymethyl)-2-phenyl-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
Compound characteristics
| Compound ID: | V027-3546 |
| Compound Name: | 4-(methoxymethyl)-2-phenyl-6-[4-(propane-1-sulfonyl)piperazin-1-yl]-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine |
| Molecular Weight: | 548.63 |
| Molecular Formula: | C27 H31 F3 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCCS(N1CCN(CC1)c1c(Cc2cccc(c2)C(F)(F)F)c(COC)nc(c2ccccc2)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0179 |
| logD: | 5.9656 |
| logSw: | -5.783 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.026 |
| InChI Key: | KAKQJGYZOCGESH-UHFFFAOYSA-N |