3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4-(3,4-dichlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4-(3,4-dichlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazole
3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4-(3,4-dichlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V011-1254 |
| Compound Name: | 3-{[(2-chloro-6-fluorophenyl)methyl]sulfanyl}-4-(3,4-dichlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 494.8 |
| Molecular Formula: | C22 H15 Cl3 F N3 O S |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)c1nnc(n1c1ccc(c(c1)[Cl])[Cl])SCc1c(cccc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 7.4293 |
| logD: | 7.4293 |
| logSw: | -6.7414 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.256 |
| InChI Key: | BYBQNKCLNIMHOM-UHFFFAOYSA-N |