[(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)(phenyl)methyl]propanedinitrile
Chemical Structure Depiction of
[(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)(phenyl)methyl]propanedinitrile
[(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)(phenyl)methyl]propanedinitrile
Compound characteristics
| Compound ID: | 3259-0066 |
| Compound Name: | [(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)(phenyl)methyl]propanedinitrile |
| Molecular Weight: | 328.37 |
| Molecular Formula: | C20 H16 N4 O |
| Smiles: | CC1C(C(C(C#N)C#N)c2ccccc2)C(N(c2ccccc2)N=1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.4282 |
| logD: | -5.4935 |
| logSw: | -2.6102 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 59.699 |
| InChI Key: | IBBUNMDCCDIBFL-UHFFFAOYSA-N |