3-{[(3,5-difluorophenyl)methyl]sulfanyl}-5-(3-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(3,5-difluorophenyl)methyl]sulfanyl}-5-(3-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole
3-{[(3,5-difluorophenyl)methyl]sulfanyl}-5-(3-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V009-4381 |
| Compound Name: | 3-{[(3,5-difluorophenyl)methyl]sulfanyl}-5-(3-methoxyphenyl)-4-phenyl-4H-1,2,4-triazole |
| Molecular Weight: | 409.46 |
| Molecular Formula: | C22 H17 F2 N3 O S |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)c1nnc(n1c1ccccc1)SCc1cc(cc(c1)F)F |
| Stereo: | ACHIRAL |
| logP: | 5.7362 |
| logD: | 5.7362 |
| logSw: | -5.6499 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.256 |
| InChI Key: | DXGLSPIFBUBYKB-UHFFFAOYSA-N |