2-{[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-{[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
2-{[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | K788-8996 |
| Compound Name: | 2-{[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 525.98 |
| Molecular Formula: | C24 H23 Cl F3 N3 O3 S |
| Smiles: | Cc1c(CS(CC(N2CCN(CC2)c2cccc(c2)C(F)(F)F)=O)=O)nc(c2ccccc2[Cl])o1 |
| Stereo: | ACHIRAL |
| logP: | 4.0999 |
| logD: | 4.0999 |
| logSw: | -4.4207 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.786 |
| InChI Key: | WZNVXQCOHBFSDN-UHFFFAOYSA-N |