4-[4-(ethanesulfonyl)piperazin-1-yl]-6-(methoxymethyl)-2-phenyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
Chemical Structure Depiction of
4-[4-(ethanesulfonyl)piperazin-1-yl]-6-(methoxymethyl)-2-phenyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
4-[4-(ethanesulfonyl)piperazin-1-yl]-6-(methoxymethyl)-2-phenyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
Compound characteristics
| Compound ID: | V027-3617 |
| Compound Name: | 4-[4-(ethanesulfonyl)piperazin-1-yl]-6-(methoxymethyl)-2-phenyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine |
| Molecular Weight: | 534.6 |
| Molecular Formula: | C26 H29 F3 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCS(N1CCN(CC1)c1c(Cc2cccc(c2)C(F)(F)F)c(COC)nc(c2ccccc2)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6716 |
| logD: | 5.6193 |
| logSw: | -5.6641 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.026 |
| InChI Key: | ULHASBOWBKXVRD-UHFFFAOYSA-N |