2-cyano-3-[5-(4-nitrophenyl)-2-furyl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Chemical Structure Depiction of
2-cyano-3-[5-(4-nitrophenyl)-2-furyl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
2-cyano-3-[5-(4-nitrophenyl)-2-furyl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide
Compound characteristics
| Compound ID: | 8013-0617 |
| Compound Name: | 2-cyano-3-[5-(4-nitrophenyl)-2-furyl]-N~1~-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]acrylamide |
| Molecular Weight: | 435.34 |
| Molecular Formula: | C17 H8 F3 N5 O4 S |
| Smiles: | C(=C(/C#N)C(Nc1nnc(C(F)(F)F)s1)=O)\c1ccc(c2ccc(cc2)[N+]([O-])=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.68 |
| logD: | 0.13 |
| logSw: | -5.41 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 230.98 |
| InChI Key: | BOJQYZVCPUYUSK-UHFFFAOYSA-N |