2-methoxy-N-({5-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)benzamide
Chemical Structure Depiction of
2-methoxy-N-({5-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)benzamide
2-methoxy-N-({5-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)benzamide
Compound characteristics
| Compound ID: | 2515-5714 |
| Compound Name: | 2-methoxy-N-({5-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)benzamide |
| Molecular Weight: | 408.4 |
| Molecular Formula: | C18 H15 F3 N4 O2 S |
| Smiles: | COc1ccccc1C(NCC1=NNC(N1c1cccc(c1)C(F)(F)F)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5942 |
| logD: | 3.2596 |
| logSw: | -4.0405 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.145 |
| InChI Key: | CZQYNUVSZKTOHU-UHFFFAOYSA-N |