[(3-chlorophenyl)(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)methyl]propanedinitrile
Chemical Structure Depiction of
[(3-chlorophenyl)(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)methyl]propanedinitrile
[(3-chlorophenyl)(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)methyl]propanedinitrile
Compound characteristics
| Compound ID: | 8009-7404 |
| Compound Name: | [(3-chlorophenyl)(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)methyl]propanedinitrile |
| Molecular Weight: | 362.82 |
| Molecular Formula: | C20 H15 Cl N4 O |
| Smiles: | CC1C(C(C(C#N)C#N)c2cccc(c2)[Cl])C(N(c2ccccc2)N=1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0256 |
| logD: | -4.8961 |
| logSw: | -3.4471 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 59.699 |
| InChI Key: | JWGRSBYMWCYBHG-UHFFFAOYSA-N |