4-hydroxy-5-(3-hydroxy-5-phenyl-1H-pyrazol-4-yl)benzene-1,2-dicarbonitrile
Chemical Structure Depiction of
4-hydroxy-5-(3-hydroxy-5-phenyl-1H-pyrazol-4-yl)benzene-1,2-dicarbonitrile
4-hydroxy-5-(3-hydroxy-5-phenyl-1H-pyrazol-4-yl)benzene-1,2-dicarbonitrile
Compound characteristics
| Compound ID: | 8020-7987 |
| Compound Name: | 4-hydroxy-5-(3-hydroxy-5-phenyl-1H-pyrazol-4-yl)benzene-1,2-dicarbonitrile |
| Molecular Weight: | 302.29 |
| Molecular Formula: | C17 H10 N4 O2 |
| Smiles: | C(c1cc(c(cc1C#N)O)c1c(n[nH]c1c1ccccc1)O)#N |
| Stereo: | ACHIRAL |
| logP: | 2.6637 |
| logD: | -0.6899 |
| logSw: | -2.9769 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.848 |
| InChI Key: | VBLRILQMKBOGPH-UHFFFAOYSA-N |