ethyl ({5-[(2-chlorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Chemical Structure Depiction of
ethyl ({5-[(2-chlorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
ethyl ({5-[(2-chlorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate
Compound characteristics
| Compound ID: | Y205-6613 |
| Compound Name: | ethyl ({5-[(2-chlorophenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetate |
| Molecular Weight: | 341.81 |
| Molecular Formula: | C14 H16 Cl N3 O3 S |
| Smiles: | CCOC(CSc1nnc(COc2ccccc2[Cl])n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2389 |
| logD: | 2.2389 |
| logSw: | -2.7663 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.043 |
| InChI Key: | JWPVGXLNNSYGIY-UHFFFAOYSA-N |