3-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)propanenitrile
Chemical Structure Depiction of
3-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)propanenitrile
3-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)propanenitrile
Compound characteristics
| Compound ID: | 8012-2648 |
| Compound Name: | 3-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)propanenitrile |
| Molecular Weight: | 227.26 |
| Molecular Formula: | C13 H13 N3 O |
| Smiles: | Cc1c(CCC#N)c(n(c2ccccc2)n1)O |
| Stereo: | ACHIRAL |
| logP: | 1.0944 |
| logD: | 0.2702 |
| logSw: | -0.8127 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.58 |
| InChI Key: | RELSYUJXVDYUNP-UHFFFAOYSA-N |