ethyl {[5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Chemical Structure Depiction of
ethyl {[5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
ethyl {[5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Compound characteristics
| Compound ID: | V015-1148 |
| Compound Name: | ethyl {[5-(furan-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate |
| Molecular Weight: | 343.4 |
| Molecular Formula: | C17 H17 N3 O3 S |
| Smiles: | CCOC(CSc1nnc(c2ccco2)n1c1cccc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4159 |
| logD: | 3.4155 |
| logSw: | -3.5447 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.721 |
| InChI Key: | NRSTXYMBNKNREW-UHFFFAOYSA-N |