4-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-2,6-dimethyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
Chemical Structure Depiction of
4-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-2,6-dimethyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
4-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-2,6-dimethyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine
Compound characteristics
| Compound ID: | V001-0201 |
| Compound Name: | 4-[4-(4-bromobenzene-1-sulfonyl)piperazin-1-yl]-2,6-dimethyl-5-{[3-(trifluoromethyl)phenyl]methyl}pyrimidine |
| Molecular Weight: | 569.44 |
| Molecular Formula: | C24 H24 Br F3 N4 O2 S |
| Salt: | not_available |
| Smiles: | Cc1c(Cc2cccc(c2)C(F)(F)F)c(nc(C)n1)N1CCN(CC1)S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0014 |
| logD: | 5.9124 |
| logSw: | -5.8589 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.632 |
| InChI Key: | DYXXCYDKIKTDFJ-UHFFFAOYSA-N |