2-{[2-(3-methoxyphenyl)-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-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | K788-8845 |
| Compound Name: | 2-{[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methanesulfinyl}-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 521.56 |
| Molecular Formula: | C25 H26 F3 N3 O4 S |
| Smiles: | Cc1c(CS(CC(N2CCN(CC2)c2cccc(c2)C(F)(F)F)=O)=O)nc(c2cccc(c2)OC)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.6754 |
| logD: | 3.6754 |
| logSw: | -4.0743 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.33 |
| InChI Key: | MFGVKHQOSFIZKV-UHFFFAOYSA-N |