[(5-{[(quinolin-8-yl)oxy]methyl}-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl)sulfanyl]acetic acid
Chemical Structure Depiction of
[(5-{[(quinolin-8-yl)oxy]methyl}-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl)sulfanyl]acetic acid
[(5-{[(quinolin-8-yl)oxy]methyl}-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl)sulfanyl]acetic acid
Compound characteristics
| Compound ID: | C663-0688 |
| Compound Name: | [(5-{[(quinolin-8-yl)oxy]methyl}-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl)sulfanyl]acetic acid |
| Molecular Weight: | 460.43 |
| Molecular Formula: | C21 H15 F3 N4 O3 S |
| Smiles: | C(c1nnc(n1c1cccc(c1)C(F)(F)F)SCC(O)=O)Oc1cccc2cccnc12 |
| Stereo: | ACHIRAL |
| logP: | 3.1148 |
| logD: | -0.1777 |
| logSw: | -3.1134 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.463 |
| InChI Key: | HVXDOBVSEYXLBV-UHFFFAOYSA-N |