3-[1-(3-chlorophenoxy)ethyl]-4-ethyl-5-{[(3-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Chemical Structure Depiction of
3-[1-(3-chlorophenoxy)ethyl]-4-ethyl-5-{[(3-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
3-[1-(3-chlorophenoxy)ethyl]-4-ethyl-5-{[(3-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y207-2370 |
| Compound Name: | 3-[1-(3-chlorophenoxy)ethyl]-4-ethyl-5-{[(3-methylphenyl)methyl]sulfanyl}-4H-1,2,4-triazole |
| Molecular Weight: | 387.93 |
| Molecular Formula: | C20 H22 Cl N3 O S |
| Smiles: | CCn1c(C(C)Oc2cccc(c2)[Cl])nnc1SCc1cccc(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9542 |
| logD: | 5.9541 |
| logSw: | -6.0659 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.7545 |
| InChI Key: | BTIXVNVAOFLZNM-HNNXBMFYSA-N |