2-[4-amino-5-sulfanylidene-3-(trifluoromethyl)-4,5-dihydro-1H-1,2,4-triazol-1-yl]-N-(2-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-[4-amino-5-sulfanylidene-3-(trifluoromethyl)-4,5-dihydro-1H-1,2,4-triazol-1-yl]-N-(2-methoxyphenyl)acetamide
2-[4-amino-5-sulfanylidene-3-(trifluoromethyl)-4,5-dihydro-1H-1,2,4-triazol-1-yl]-N-(2-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | 8014-1860 |
| Compound Name: | 2-[4-amino-5-sulfanylidene-3-(trifluoromethyl)-4,5-dihydro-1H-1,2,4-triazol-1-yl]-N-(2-methoxyphenyl)acetamide |
| Molecular Weight: | 347.32 |
| Molecular Formula: | C12 H12 F3 N5 O2 S |
| Smiles: | COc1ccccc1NC(CN1C(N(C(C(F)(F)F)=N1)N)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3906 |
| logD: | 1.3906 |
| logSw: | -2.3231 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 65.969 |
| InChI Key: | YQFYULBNYYXVHF-UHFFFAOYSA-N |