CAS 13051-04-2

4-Chloro-2,4-dihydro-4-phenyl-5-(phenylmethyl)-3H-pyrazol-3-one

Description:

4-Chloro-2,4-dihydro-4-phenyl-5-(phenylmethyl)-3H-pyrazol-3-one, with the CAS number 13051-04-2, is a chemical compound that belongs to the class of pyrazolones, which are characterized by a five-membered ring containing two nitrogen atoms. This compound features a chloro substituent and multiple phenyl groups, contributing to its potential as a bioactive molecule. It typically exhibits a solid state at room temperature and may have moderate solubility in organic solvents. The presence of the chloro group can influence its reactivity and interaction with biological targets, making it of interest in medicinal chemistry. Pyrazolone derivatives are often studied for their anti-inflammatory, analgesic, and antipyretic properties. The specific structure of this compound suggests potential applications in pharmaceuticals, although detailed studies on its biological activity and toxicity would be necessary to fully understand its characteristics and potential uses. As with all chemical substances, proper handling and safety measures should be observed due to potential hazards associated with its use.

Formula: C₁₆H₁₃ClN₂O

InChI: InChI=1S/C16H13ClN2O/c17-16(13-9-5-2-6-10-13)14(18-19-15(16)20)11-12-7-3-1-4-8-12/h1-10H,11H2,(H,19,20)

InChI key: InChIKey=DUPSXUVUVFASTA-UHFFFAOYSA-N

SMILES: ClC1(C(CC2=CC=CC=C2)=NNC1=O)C3=CC=CC=C3

Synonyms:

• 3H-Pyrazol-3-one, 4-chloro-2,4-dihydro-4-phenyl-5-(phenylmethyl)-
• 2-Pyrazolin-5-one, 3-benzyl-4-chloro-4-phenyl-
• 4-Chloro-2,4-dihydro-4-phenyl-5-(phenylmethyl)-3H-pyrazol-3-one
• 3-Benzyl-4-chloro-4-phenyl-1H-pyrazol-5-one
• NSC 109907

3H-Pyrazol-3-one, 4-chloro-2,4-dihydro-4-phenyl-5-(phenylmethyl)-

CAS: 13051-04-2

Formula: C₁₆H₁₃ClN₂O

Molecular weight: 284.7402

Ref: IN-DA000UJG