2-({5-(furan-2-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-({5-(furan-2-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[(oxolan-2-yl)methyl]acetamide
2-({5-(furan-2-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | V005-1528 |
| Compound Name: | 2-({5-(furan-2-yl)-4-[3-(trifluoromethyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[(oxolan-2-yl)methyl]acetamide |
| Molecular Weight: | 452.45 |
| Molecular Formula: | C20 H19 F3 N4 O3 S |
| Salt: | not_available |
| Smiles: | C1CC(CNC(CSc2nnc(c3ccco3)n2c2cccc(c2)C(F)(F)F)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6997 |
| logD: | 2.6997 |
| logSw: | -3.1252 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.417 |
| InChI Key: | DMJWMLNTIYBVPL-OAHLLOKOSA-N |