1-(4-ethylphenyl)-2-{[5-(furan-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(4-ethylphenyl)-2-{[5-(furan-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
1-(4-ethylphenyl)-2-{[5-(furan-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | 8008-6394 |
| Compound Name: | 1-(4-ethylphenyl)-2-{[5-(furan-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 389.47 |
| Molecular Formula: | C22 H19 N3 O2 S |
| Smiles: | CCc1ccc(cc1)C(CSc1nnc(c2ccco2)n1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6733 |
| logD: | 4.6733 |
| logSw: | -4.4242 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.538 |
| InChI Key: | JRVKYZJABJKPEV-UHFFFAOYSA-N |