2-phenyl-N-({5-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)acetamide
Chemical Structure Depiction of
2-phenyl-N-({5-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)acetamide
2-phenyl-N-({5-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)acetamide
Compound characteristics
| Compound ID: | 2515-5721 |
| Compound Name: | 2-phenyl-N-({5-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-4,5-dihydro-1H-1,2,4-triazol-3-yl}methyl)acetamide |
| Molecular Weight: | 392.4 |
| Molecular Formula: | C18 H15 F3 N4 O S |
| Smiles: | C(C(NCC1=NNC(N1c1cccc(c1)C(F)(F)F)=S)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3568 |
| logD: | 3.0221 |
| logSw: | -3.6943 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.301 |
| InChI Key: | NKFNQORAJSPULM-UHFFFAOYSA-N |