5-[1-(3-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
Chemical Structure Depiction of
5-[1-(3-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
5-[1-(3-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | L950-0657 |
| Compound Name: | 5-[1-(3-methylbenzene-1-sulfonyl)pyrrolidin-2-yl]-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole |
| Molecular Weight: | 437.44 |
| Molecular Formula: | C20 H18 F3 N3 O3 S |
| Smiles: | Cc1cccc(c1)S(N1CCCC1c1nc(c2cccc(c2)C(F)(F)F)no1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2641 |
| logD: | 5.2641 |
| logSw: | -5.3194 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.192 |
| InChI Key: | XFPLGLHNNMWYBL-KRWDZBQOSA-N |