3-{[(2,4-difluorophenyl)methyl]sulfanyl}-4-(4-methoxyphenyl)-5-(2-methylphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2,4-difluorophenyl)methyl]sulfanyl}-4-(4-methoxyphenyl)-5-(2-methylphenyl)-4H-1,2,4-triazole
3-{[(2,4-difluorophenyl)methyl]sulfanyl}-4-(4-methoxyphenyl)-5-(2-methylphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V009-5284 |
| Compound Name: | 3-{[(2,4-difluorophenyl)methyl]sulfanyl}-4-(4-methoxyphenyl)-5-(2-methylphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 423.48 |
| Molecular Formula: | C23 H19 F2 N3 O S |
| Salt: | not_available |
| Smiles: | Cc1ccccc1c1nnc(n1c1ccc(cc1)OC)SCc1ccc(cc1F)F |
| Stereo: | ACHIRAL |
| logP: | 5.7815 |
| logD: | 5.7815 |
| logSw: | -5.6625 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.256 |
| InChI Key: | SQSPBLGLNWHWNS-UHFFFAOYSA-N |