CAS 1020252-20-3

2-[[(2,3-Dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino]methylene]-4,4-dimethyl-3-oxopentanenitrile

Description:

The chemical substance known as 2-[[(2,3-Dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino]methylene]-4,4-dimethyl-3-oxopentanenitrile, with the CAS number 1020252-20-3, is a complex organic compound characterized by its unique structural features. It contains a pyrazole ring, which is a five-membered ring with two adjacent nitrogen atoms, contributing to its potential biological activity. The presence of multiple functional groups, including a nitrile group and ketone functionalities, suggests that this compound may exhibit diverse reactivity and potential applications in medicinal chemistry. The dimethyl and phenyl substituents enhance its lipophilicity, which can influence its pharmacokinetic properties. Additionally, the compound's structural complexity may allow for interactions with various biological targets, making it a candidate for further investigation in drug development. Overall, this substance exemplifies the intricate relationship between molecular structure and biological activity, warranting further study to elucidate its potential therapeutic applications.

Formula: C₁₉H₂₂N₄O₂

InChI: InChI=1S/C19H22N4O2/c1-13-16(21-12-14(11-20)17(24)19(2,3)4)18(25)23(22(13)5)15-9-7-6-8-10-15/h6-10,12,21H,1-5H3

InChI key: InChIKey=UNYZFCCPTZWCMZ-UHFFFAOYSA-N

SMILES: O=C1N(N(C)C(C)=C1NC=C(C(C(C)(C)C)=O)C#N)C2=CC=CC=C2

Synonyms:

• 2-[[(2,3-Dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino]methylene]-4,4-dimethyl-3-oxopentanenitrile
• Pentanenitrile, 2-[[(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino]methylene]-4,4-dimethyl-3-oxo-

3-((2,3-dimethyl-5-oxo-1-phenyl(3-pyrazolin-4-yl))amino)-2-(2,2-dimethylpropanoyl)prop-2-enenitrile

CAS: 1020252-20-3

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Formula: C₁₉H₂₂N₄O₂

Purity: Min. 95%

Molecular weight: 338.4 g/mol

Ref: 3D-VQB25220