5-amino-3-{1-cyano-2-[4-(propan-2-yl)phenyl]ethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-amino-3-{1-cyano-2-[4-(propan-2-yl)phenyl]ethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
5-amino-3-{1-cyano-2-[4-(propan-2-yl)phenyl]ethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Compound characteristics
| Compound ID: | 1809-0151 |
| Compound Name: | 5-amino-3-{1-cyano-2-[4-(propan-2-yl)phenyl]ethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile |
| Molecular Weight: | 321.38 |
| Molecular Formula: | C18 H19 N5 O |
| Smiles: | [H]N([H])c1c(C#N)c(/C(=C/c2ccc(cc2)C(C)C)C#N)nn1CCO[H] |
| Stereo: | ACHIRAL |
| logP: | 2.3323 |
| logD: | 2.3323 |
| logSw: | -2.0688 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.711 |
| InChI Key: | ZGSLVHRSVIEGHT-UHFFFAOYSA-N |