ethyl {[4-methyl-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[4-methyl-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
ethyl {[4-methyl-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | Y205-5801 |
| Compound Name: | ethyl {[4-methyl-5-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate |
| Molecular Weight: | 305.4 |
| Molecular Formula: | C15 H19 N3 O2 S |
| Smiles: | CCOC(CSc1nnc(CCc2ccccc2)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5728 |
| logD: | 2.5727 |
| logSw: | -2.514 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.457 |
| InChI Key: | FSCPWYRYRQJRNH-UHFFFAOYSA-N |