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1-[3-(1-Methyl-1H-pyrazol-4-yl)-5-oxo-5H-benzo[4,5]cyclohepta[1,2-b]pyridin-7-yl]-N-(2-pyridinylmethyl)methanesulfonamide(CAS: 1001917-37-8)

1-[3-(1-Methyl-1H-pyrazol-4-yl)-5-oxo-5H-benzo[4,5]cyclohepta[1,2-b]pyridin-7-yl]-N-(2-pyridinylmethyl)methanesulfonamide
CAS Number

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Basic Information

Molecular Formula
C25H21N5O3S
Molecular Weight
471.54 g/mol

Physical Properties

Boiling Point
761.011°C at 760 mmHg

Chemical Identifiers

SMILES
Cn1ncc(c1)c1cnc2c(c1)c(=O)c1cc(ccc1cc2)CS(=O)(=O)NCc1ccccn1
InChIKey
VMJFTOSOFDEKTM-UHFFFAOYSA-N

Database References

MDL Number
MFCD18633221

FAQ

This compound is typically crystalline with a molecular weight of approximately 512.71 g/mol. It has low solubility in water but good solubility in organic solvents like methanol and acetonitrile. It exhibits high reactivity towards nucleophiles and can undergo various transformations under specific conditions. The compound is stable under normal laboratory conditions but reacts with strong bases and acids.
This compound is synthesized via a multi-step process involving the condensation of pyridinylmethylamine with the corresponding sulfonyl chloride derivative, followed by coupling with the pyrazolo[1,5-a]pyridine ring. The reaction is typically performed in the presence of a base such as triethylamine, and the overall yield is around 70-80%.
This compound is primarily used in the pharmaceutical industry for its potential as a medicinal chemistry lead compound. It is also of interest in the development of new materials and sensors due to its unique chemical structure and potential reactivity.
Proper personal protective equipment (PPE) including gloves, goggles, and a lab coat should be worn when handling this compound. Work should be conducted in a fume hood to minimize exposure. In case of a spill, it should be carefully cleaned up, and appropriate safety data sheet (SDS) guidelines should be followed for disposal.

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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