2-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-4-[3-(trifluoromethyl)phenyl]pyrimidine
Chemical Structure Depiction of
2-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-4-[3-(trifluoromethyl)phenyl]pyrimidine
2-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-4-[3-(trifluoromethyl)phenyl]pyrimidine
Compound characteristics
| Compound ID: | V006-5036 |
| Compound Name: | 2-[4-(3-chloro-4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-4-[3-(trifluoromethyl)phenyl]pyrimidine |
| Molecular Weight: | 500.9 |
| Molecular Formula: | C21 H17 Cl F4 N4 O2 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN1c1nccc(c2cccc(c2)C(F)(F)F)n1)S(c1ccc(c(c1)[Cl])F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2521 |
| logD: | 5.252 |
| logSw: | -5.9994 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.868 |
| InChI Key: | HXMLYMFGKPJRNS-UHFFFAOYSA-N |