3-fluoro-N-({5-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)benzamide
Chemical Structure Depiction of
3-fluoro-N-({5-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)benzamide
3-fluoro-N-({5-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)benzamide
Compound characteristics
| Compound ID: | 3330-2604 |
| Compound Name: | 3-fluoro-N-({5-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)benzamide |
| Molecular Weight: | 396.36 |
| Molecular Formula: | C17 H12 F4 N4 O S |
| Smiles: | C(C1=NNC(N1c1cccc(c1)C(F)(F)F)=S)NC(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5941 |
| logD: | 3.2595 |
| logSw: | -3.9021 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.514 |
| InChI Key: | HBASCXUQIGBGJW-UHFFFAOYSA-N |