3-{[(2,6-dichlorophenyl)methyl]sulfanyl}-4-ethyl-5-[(4-methoxyphenoxy)methyl]-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(2,6-dichlorophenyl)methyl]sulfanyl}-4-ethyl-5-[(4-methoxyphenoxy)methyl]-4H-1,2,4-triazole
3-{[(2,6-dichlorophenyl)methyl]sulfanyl}-4-ethyl-5-[(4-methoxyphenoxy)methyl]-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-6611 |
| Compound Name: | 3-{[(2,6-dichlorophenyl)methyl]sulfanyl}-4-ethyl-5-[(4-methoxyphenoxy)methyl]-4H-1,2,4-triazole |
| Molecular Weight: | 424.35 |
| Molecular Formula: | C19 H19 Cl2 N3 O2 S |
| Smiles: | CCn1c(COc2ccc(cc2)OC)nnc1SCc1c(cccc1[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1144 |
| logD: | 5.1144 |
| logSw: | -5.6677 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.985 |
| InChI Key: | MONQVLOUNYYKOC-UHFFFAOYSA-N |