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(1S,2S,3R,4R)-3-[(5-Chloro-2-{[(7S)-1-methoxy-7-(4-morpholinyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-2-yl]amino}-4-pyrimidinyl)amino]bicyclo[2.2.1]hept-5-ene-2-carboxamide(CAS: 1022958-60-6)

(1S,2S,3R,4R)-3-[(5-Chloro-2-{[(7S)-1-methoxy-7-(4-morpholinyl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-2-yl]amino}-4-pyrimidinyl)amino]bicyclo[2.2.1]hept-5-ene-2-carboxamide
CAS Number

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Basic Information

Molecular Formula
C28H35ClN6O3
Molecular Weight
539.08 g/mol

Chemical Identifiers

SMILES
COc1c(ccc2c1CCC(CC2)N1CCOCC1)Nc1ncc(c(n1)NC1C2C=CC(C1C(=O)N)C2)Cl
InChIKey
LAJAFFLJAJMYLK-CVOKMOJFSA-N

Database References

MDL Number
MFCD30528922

FAQ

This compound is a crystalline solid with a molecular weight of approximately 612.83 g/mol. It has a high solubility in polar solvents like dimethylformamide (DMF) and methanol. Chemically, it is reactive, particularly with nucleophiles and bases. It is stable under normal storage conditions but should be handled under an inert atmosphere to prevent decomposition.
This compound is synthesized via a multi-step process involving coupling reactions and ring-forming steps. Commonly, a pyrimidine derivative is coupled with a bicyclic amine under basic conditions, followed by ring closure to form the desired bicyclic ring system. The reaction is catalyzed by palladium and proceeds with high selectivity and yield.
This compound is primarily used in the pharmaceutical industry for its potential as an active pharmaceutical ingredient (API) in targeted drug delivery systems. It may also find application in the development of novel materials for sensors and semiconductors due to its unique chemical structure.
When handling this compound, ensure the use of personal protective equipment (PPE) including gloves, goggles, and a lab coat. Work must be conducted in a well-ventilated area or under a fume hood. Spills should be cleaned up immediately using appropriate absorbent materials. Refer to the Material Safety Data Sheet (MSDS) for detailed safety information and emergency response 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

Contact Person

Fang Rui

Email

wangkang@jskchem.com

Mobile

15221441005

Telephone

15221441005

Address

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