methyl ({5-[3-(4-chloro-2-methylphenoxy)propyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Chemical Structure Depiction of
methyl ({5-[3-(4-chloro-2-methylphenoxy)propyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
methyl ({5-[3-(4-chloro-2-methylphenoxy)propyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | Y205-7479 |
| Compound Name: | methyl ({5-[3-(4-chloro-2-methylphenoxy)propyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate |
| Molecular Weight: | 383.9 |
| Molecular Formula: | C17 H22 Cl N3 O3 S |
| Smiles: | CCn1c(CCCOc2ccc(cc2C)[Cl])nnc1SCC(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.0013 |
| logD: | 4.0009 |
| logSw: | -4.4241 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.297 |
| InChI Key: | HFSCLBGWYCJADB-UHFFFAOYSA-N |