CAS 1017781-16-6

1-(2,3-Dichlorophenyl)-3-(1,1-dimethylethyl)-1H-pyrazol-5-amine

Description:

1-(2,3-Dichlorophenyl)-3-(1,1-dimethylethyl)-1H-pyrazol-5-amine, identified by its CAS number 1017781-16-6, is a chemical compound characterized by its pyrazole core, which is a five-membered ring containing two nitrogen atoms. This compound features a dichlorophenyl group, indicating the presence of two chlorine substituents on a phenyl ring, which can influence its reactivity and biological activity. The tert-butyl group (1,1-dimethylethyl) contributes to its steric bulk, potentially affecting its interaction with biological targets. The presence of an amine functional group suggests that it may engage in hydrogen bonding, enhancing its solubility in polar solvents. This compound may exhibit various pharmacological properties, making it of interest in medicinal chemistry. Its specific characteristics, such as melting point, solubility, and stability, would depend on the molecular interactions and the environment in which it is studied. Overall, this compound's unique structure positions it as a candidate for further research in drug development and chemical synthesis.

Formula: C₁₃H₁₅Cl₂N₃

InChI: InChI=1S/C13H15Cl2N3/c1-13(2,3)10-7-11(16)18(17-10)9-6-4-5-8(14)12(9)15/h4-7H,16H2,1-3H3

InChI key: InChIKey=MSMMDDAKNWVNGL-UHFFFAOYSA-N

SMILES: NC=1N(N=C(C(C)(C)C)C1)C2=C(Cl)C(Cl)=CC=C2

Synonyms:

• 1-(2,3-Dichlorophenyl)-3-(1,1-dimethylethyl)-1H-pyrazol-5-amine
• 1H-Pyrazol-5-amine, 1-(2,3-dichlorophenyl)-3-(1,1-dimethylethyl)-

3-(tert-Butyl)-1-(2,3-dichlorophenyl)-1H-pyrazol-5-amine

CAS: 1017781-16-6

Formula: C₁₃H₁₅Cl₂N₃

Molecular weight: 284.1843

Ref: IN-DA0005H6