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4-Methyl-1-(1H-pyrazol-4-ylmethyl)-5-[(4-{[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino}-1-piperidinyl)methyl]-1H-indole-2-carbonitrile(CAS: 1857417-13-0)

4-Methyl-1-(1H-pyrazol-4-ylmethyl)-5-[(4-{[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino}-1-piperidinyl)methyl]-1H-indole-2-carbonitrile
CAS Number

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Basic Information

Molecular Formula
C28H27F3N8S
Molecular Weight
564.63 g/mol

Chemical Identifiers

SMILES
Cc1c(ccc2c1cc(n2Cc3c[nH]nc3)C#N)CN4CCC(CC4)Nc5c6cc(sc6ncn5)CC(F)(F)F
InChIKey
DETOMBLLEOZTMZ-UHFFFAOYSA-N

Database References

MDL Number
MFCD28506303

FAQ

This compound is a crystalline solid with a molecular weight of approximately 744.97 g/mol. It has limited solubility in water but good solubility in organic solvents such as dichloromethane and acetonitrile. Chemically, it is reactive towards nucleophiles and can undergo substitution reactions. It is stable under normal conditions but should be stored in a dry, cool place away from direct sunlight.
This compound is typically synthesized through a multi-step process involving the condensation of a pyrazole derivative and a substituted piperidine. The synthesis requires careful control of reaction conditions and the use of appropriate catalysts to achieve high selectivity and yield. Detailed protocols can be found in chemical literature.
This compound is primarily used in the pharmaceutical industry due to its potential as a drug candidate. It may also have applications in the development of sensors and semiconductor materials, although its use in these areas is not as common.
When handling this compound, it is crucial to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted under a fume hood to minimize exposure. In case of spill, immediately clean up using absorbent materials and dispose of waste according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed safety information.

Safety Notice

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

Always follow proper handling procedures

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