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1H-Pyrazole-4-carboxamide,5-amino-3-[4-[[(5-fluoro-2-methoxybenzoyl)amino]methyl]phenyl]-1-[(1S)-2,2,2-trifluoro-1-methylethyl](CAS: 2101700-15-4)

1H-Pyrazole-4-carboxamide,5-amino-3-[4-[[(5-fluoro-2-methoxybenzoyl)amino]methyl]phenyl]-1-[(1S)-2,2,2-trifluoro-1-methylethyl]
CAS Number

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Basic Information

Molecular Formula
C22H21F4N5O3
Molecular Weight
479.43 g/mol

Chemical Identifiers

SMILES
COC1=C(C=C(F)C=C1)C(=O)NCC1=CC=C(C=C1)C1=NN([C@@H](C)C(F)(F)F)C(N)=C1C(N)=O
InChIKey
FWZAWAUZXYCBKZ-NSHDSACASA-N

Database References

MDL Number
MFCD34179491

FAQ

The compound has a crystalline form with a molecular weight of approximately 514.4 g/mol. It is moderately soluble in water and more soluble in common organic solvents like DMSO and DMF. The compound is known for its reactivity, particularly in nucleophilic substitution reactions. It exhibits good stability under normal temperature and pressure conditions but requires handling under an inert atmosphere to prevent oxidation.
The compound is typically synthesized using a multi-step process involving the condensation of an amine with a benzoyl chloride derivative, followed by amidation. Key steps include the use of a base like triethylamine and a solvent such as DMF. The overall yield is around 60-70%, with good selectivity. The synthesis requires careful control of reaction conditions and temperature to achieve the desired product.
This compound finds applications in the pharmaceutical industry due to its biological activity. It is used in the development of drugs targeting various diseases, including cancer and neurological disorders. Additionally, it has potential in the sensor industry for developing chemical sensors and in semiconductor technology for its electronic properties.
Handling the compound should be done with appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Work should be conducted in a fume hood to minimize inhalation risks. Spills should be cleaned up with caution using appropriate absorbents, and the area should be well-ventilated. Always refer to the Safety Data Sheet (SDS) for detailed information on handling and disposal procedures.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

Contact Information

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Gong Siyu

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Beijing Solabio Technology Co., Ltd.