methyl {[5-(furan-2-yl)-4-propyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
methyl {[5-(furan-2-yl)-4-propyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
methyl {[5-(furan-2-yl)-4-propyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | Y206-5514 |
| Compound Name: | methyl {[5-(furan-2-yl)-4-propyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate |
| Molecular Weight: | 281.33 |
| Molecular Formula: | C12 H15 N3 O3 S |
| Smiles: | CCCn1c(c2ccco2)nnc1SCC(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.8564 |
| logD: | 1.8561 |
| logSw: | -2.0528 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.648 |
| InChI Key: | GDIJUHCLIYRAPQ-UHFFFAOYSA-N |