CAS 90993-87-6

1,2-Dihydro-3H-pyrazolo[3,4-d]pyrimidin-3-one

Description:

1,2-Dihydro-3H-pyrazolo[3,4-d]pyrimidin-3-one, with the CAS number 90993-87-6, is a heterocyclic compound characterized by its fused pyrazole and pyrimidine rings. This compound typically exhibits a solid-state structure and is known for its potential biological activities, making it of interest in medicinal chemistry. It often appears as a crystalline solid and may have moderate solubility in polar organic solvents. The presence of the pyrazolo and pyrimidinone moieties contributes to its reactivity and potential interactions with biological targets. Its molecular structure includes nitrogen atoms that can participate in hydrogen bonding, influencing its pharmacological properties. Additionally, derivatives of this compound may exhibit varied activities, including anti-inflammatory and anti-cancer effects, which are subjects of ongoing research. Overall, 1,2-Dihydro-3H-pyrazolo[3,4-d]pyrimidin-3-one represents a versatile scaffold in drug discovery, with implications for developing new therapeutic agents.

Formula: C₅H₄N₄O

InChI: InChI=1S/C5H4N4O/c10-5-3-1-6-2-7-4(3)8-9-5/h1-2H,(H2,6,7,8,9,10)

InChI key: InChIKey=JTNQNHQPENYUGB-UHFFFAOYSA-N

SMILES: O=C1C=2C(=NC=NC2)NN1

Synonyms:

• Pyrazolo[3,4-d]pyrimidin-3-ol
• 3H-Pyrazolo[3,4-d]pyrimidin-3-one, 1,2-dihydro-
• 1H-Pyrazolo[3,4-d]pyrimidin-3-ol
• 1,2-Dihydro-3H-pyrazolo[3,4-d]pyrimidin-3-one
• 1H-Pyrazolo[3,4-d]pyrimidin-3(2H)-one