3-{[(2-fluorophenyl)methyl]sulfanyl}-5-(2-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2-fluorophenyl)methyl]sulfanyl}-5-(2-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazole
3-{[(2-fluorophenyl)methyl]sulfanyl}-5-(2-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V003-6694 |
| Compound Name: | 3-{[(2-fluorophenyl)methyl]sulfanyl}-5-(2-methoxyphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 421.49 |
| Molecular Formula: | C23 H20 F N3 O2 S |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)n1c(c2ccccc2OC)nnc1SCc1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 5.2578 |
| logD: | 5.2578 |
| logSw: | -5.2493 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.887 |
| InChI Key: | GQDYUZDIDVHJOI-UHFFFAOYSA-N |