5-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-4-[2-(trifluoromethyl)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-4-[2-(trifluoromethyl)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-4-[2-(trifluoromethyl)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8013-2032 |
| Compound Name: | 5-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-4-[2-(trifluoromethyl)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 417.41 |
| Molecular Formula: | C19 H14 F3 N5 O S |
| Smiles: | COc1ccc(cc1)c1cc(C2=NNC(N2c2ccccc2C(F)(F)F)=S)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 5.0808 |
| logD: | 4.1278 |
| logSw: | -4.9664 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.706 |
| InChI Key: | FQRXZPVTIWRBOW-UHFFFAOYSA-N |