5-amino-3-{1-cyano-2-[4-(propan-2-yl)phenyl]ethenyl}-1-phenyl-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-amino-3-{1-cyano-2-[4-(propan-2-yl)phenyl]ethenyl}-1-phenyl-1H-pyrazole-4-carbonitrile
5-amino-3-{1-cyano-2-[4-(propan-2-yl)phenyl]ethenyl}-1-phenyl-1H-pyrazole-4-carbonitrile
Compound characteristics
| Compound ID: | 8007-2450 |
| Compound Name: | 5-amino-3-{1-cyano-2-[4-(propan-2-yl)phenyl]ethenyl}-1-phenyl-1H-pyrazole-4-carbonitrile |
| Molecular Weight: | 353.43 |
| Molecular Formula: | C22 H19 N5 |
| Smiles: | CC(C)c1ccc(/C=C(C#N)/c2c(C#N)c(N)n(c3ccccc3)n2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5149 |
| logD: | 4.5149 |
| logSw: | -4.6362 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.942 |
| InChI Key: | JSLZGOPWQNELJQ-UHFFFAOYSA-N |