5-amino-3-{1-cyano-2-[5-(2-nitrophenyl)furan-2-yl]ethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-amino-3-{1-cyano-2-[5-(2-nitrophenyl)furan-2-yl]ethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
5-amino-3-{1-cyano-2-[5-(2-nitrophenyl)furan-2-yl]ethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Compound characteristics
| Compound ID: | 2039-0596 |
| Compound Name: | 5-amino-3-{1-cyano-2-[5-(2-nitrophenyl)furan-2-yl]ethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile |
| Molecular Weight: | 390.36 |
| Molecular Formula: | C19 H14 N6 O4 |
| Smiles: | [H]N([H])c1c(C#N)c(/C(=C/c2ccc(c3ccccc3[N+]([O-])=O)o2)C#N)nn1CCO[H] |
| Stereo: | ACHIRAL |
| logP: | 1.6733 |
| logD: | 1.6733 |
| logSw: | -2.4149 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 125.362 |
| InChI Key: | LHOFHJHNQJHLOG-UHFFFAOYSA-N |