3-{[(2,6-dichlorophenyl)methyl]sulfanyl}-4-methyl-5-[1-(3-methylphenoxy)ethyl]-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2,6-dichlorophenyl)methyl]sulfanyl}-4-methyl-5-[1-(3-methylphenoxy)ethyl]-4H-1,2,4-triazole
3-{[(2,6-dichlorophenyl)methyl]sulfanyl}-4-methyl-5-[1-(3-methylphenoxy)ethyl]-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-1076 |
| Compound Name: | 3-{[(2,6-dichlorophenyl)methyl]sulfanyl}-4-methyl-5-[1-(3-methylphenoxy)ethyl]-4H-1,2,4-triazole |
| Molecular Weight: | 408.35 |
| Molecular Formula: | C19 H19 Cl2 N3 O S |
| Smiles: | CC(c1nnc(n1C)SCc1c(cccc1[Cl])[Cl])Oc1cccc(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6706 |
| logD: | 5.6706 |
| logSw: | -5.9938 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.84 |
| InChI Key: | RENBJCRGALTCFN-ZDUSSCGKSA-N |