ethyl [(5-cyclopentyl-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetate
Chemical Structure Depiction of
ethyl [(5-cyclopentyl-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetate
ethyl [(5-cyclopentyl-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | Y206-3096 |
| Compound Name: | ethyl [(5-cyclopentyl-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetate |
| Molecular Weight: | 283.39 |
| Molecular Formula: | C13 H21 N3 O2 S |
| Smiles: | CCn1c(C2CCCC2)nnc1SCC(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 2.8514 |
| logD: | 2.8507 |
| logSw: | -2.7785 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.954 |
| InChI Key: | NAPHSMDSBSMMBH-UHFFFAOYSA-N |