3-(2-chlorophenyl)-5-{[(4-chlorophenyl)methyl]sulfanyl}-4-(3,4-dichlorophenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(2-chlorophenyl)-5-{[(4-chlorophenyl)methyl]sulfanyl}-4-(3,4-dichlorophenyl)-4H-1,2,4-triazole
3-(2-chlorophenyl)-5-{[(4-chlorophenyl)methyl]sulfanyl}-4-(3,4-dichlorophenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V030-7544 |
| Compound Name: | 3-(2-chlorophenyl)-5-{[(4-chlorophenyl)methyl]sulfanyl}-4-(3,4-dichlorophenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 481.23 |
| Molecular Formula: | C21 H13 Cl4 N3 S |
| Salt: | not_available |
| Smiles: | C(c1ccc(cc1)[Cl])Sc1nnc(c2ccccc2[Cl])n1c1ccc(c(c1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.2467 |
| logD: | 7.2467 |
| logSw: | -6.9822 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.7125 |
| InChI Key: | AGUXUXKXRONRGN-UHFFFAOYSA-N |