4-methyl-3-[1-(3-methylphenoxy)ethyl]-5-{[(2-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Chemical Structure Depiction of
4-methyl-3-[1-(3-methylphenoxy)ethyl]-5-{[(2-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
4-methyl-3-[1-(3-methylphenoxy)ethyl]-5-{[(2-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-8559 |
| Compound Name: | 4-methyl-3-[1-(3-methylphenoxy)ethyl]-5-{[(2-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole |
| Molecular Weight: | 353.48 |
| Molecular Formula: | C20 H23 N3 O S |
| Smiles: | CC(c1nnc(n1C)SCc1ccccc1C)Oc1cccc(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1885 |
| logD: | 5.1885 |
| logSw: | -5.07 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.84 |
| InChI Key: | BETFKNKYMUBCGY-INIZCTEOSA-N |