2,4-dimethyl-5-{[3-(trifluoromethyl)phenyl]methyl}-6-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]pyrimidine
Chemical Structure Depiction of
2,4-dimethyl-5-{[3-(trifluoromethyl)phenyl]methyl}-6-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]pyrimidine
2,4-dimethyl-5-{[3-(trifluoromethyl)phenyl]methyl}-6-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]pyrimidine
Compound characteristics
| Compound ID: | V011-8409 |
| Compound Name: | 2,4-dimethyl-5-{[3-(trifluoromethyl)phenyl]methyl}-6-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]pyrimidine |
| Molecular Weight: | 532.63 |
| Molecular Formula: | C27 H31 F3 N4 O2 S |
| Salt: | not_available |
| Smiles: | Cc1cc(C)c(c(C)c1)S(N1CCN(CC1)c1c(Cc2cccc(c2)C(F)(F)F)c(C)nc(C)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4413 |
| logD: | 6.3523 |
| logSw: | -5.9721 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.632 |
| InChI Key: | ZBHPHTVXXWHFAQ-UHFFFAOYSA-N |