2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-[5-(4-nitrophenyl)furan-2-yl]ethan-1-one
Chemical Structure Depiction of
2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-[5-(4-nitrophenyl)furan-2-yl]ethan-1-one
2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-[5-(4-nitrophenyl)furan-2-yl]ethan-1-one
Compound characteristics
| Compound ID: | 7575-0365 |
| Compound Name: | 2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-[5-(4-nitrophenyl)furan-2-yl]ethan-1-one |
| Molecular Weight: | 482.52 |
| Molecular Formula: | C26 H18 N4 O4 S |
| Smiles: | C(C(c1ccc(c2ccc(cc2)[N+]([O-])=O)o1)=O)Sc1nnc(c2ccccc2)n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.9395 |
| logD: | 5.9395 |
| logSw: | -6.0835 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.74 |
| InChI Key: | DCYOQXNSECTTBI-UHFFFAOYSA-N |