3-(2-chlorophenyl)-4-(2-methoxyphenyl)-5-{[(2-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(2-chlorophenyl)-4-(2-methoxyphenyl)-5-{[(2-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
3-(2-chlorophenyl)-4-(2-methoxyphenyl)-5-{[(2-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V012-0330 |
| Compound Name: | 3-(2-chlorophenyl)-4-(2-methoxyphenyl)-5-{[(2-methoxyphenyl)methyl]sulfanyl}-4H-1,2,4-triazole |
| Molecular Weight: | 437.95 |
| Molecular Formula: | C23 H20 Cl N3 O2 S |
| Salt: | not_available |
| Smiles: | COc1ccccc1CSc1nnc(c2ccccc2[Cl])n1c1ccccc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.5022 |
| logD: | 5.5022 |
| logSw: | -5.8654 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.672 |
| InChI Key: | KBUDABVGIRKTBN-UHFFFAOYSA-N |