CAS 1033463-25-0

5-Amino-1-(2-benzoxazolyl)-2,3-dihydro-1H-pyrazole-4-carbonitrile

Description:

5-Amino-1-(2-benzoxazolyl)-2,3-dihydro-1H-pyrazole-4-carbonitrile is a chemical compound characterized by its complex structure, which includes a pyrazole ring, an amino group, and a benzoxazole moiety. This compound typically exhibits properties such as moderate solubility in polar solvents and potential bioactivity, making it of interest in medicinal chemistry. The presence of the carbonitrile group suggests it may participate in nucleophilic reactions, while the benzoxazole ring can contribute to its aromatic stability and potential interactions with biological targets. The compound's molecular structure may allow for hydrogen bonding and π-π stacking interactions, which are relevant in drug design and development. Additionally, the presence of the amino group can enhance its reactivity and solubility in biological systems. Overall, this compound's unique features make it a candidate for further research, particularly in the fields of pharmaceuticals and agrochemicals.

Formula: C₁₁H₉N₅O

InChI: InChI=1S/C11H9N5O/c12-5-7-6-14-16(10(7)13)11-15-8-3-1-2-4-9(8)17-11/h1-4,14H,6,13H2

InChI key: InChIKey=DVCKMBGSVVAYCZ-UHFFFAOYSA-N

SMILES: NC=1N(C2=NC=3C(O2)=CC=CC3)NCC1C#N

Synonyms:

• 1H-Pyrazole-4-carbonitrile, 5-amino-1-(2-benzoxazolyl)-2,3-dihydro-
• 5-Amino-1-(2-benzoxazolyl)-2,3-dihydro-1H-pyrazole-4-carbonitrile