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AA09688

102518-79-6 | (1R,9R)-1-amino-13-ethylidene-11-methyl-6-azatricyclo[7.3.1.0^{2,7}]trideca-2(7),3,10-trien-5-one

Packsize Purity Availability Price Discounted Price    Quantity
100mg 99% in stock $38.00 $27.00 -   +

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Description
Catalog Number: AA09688
Chemical Name: (1R,9R)-1-amino-13-ethylidene-11-methyl-6-azatricyclo[7.3.1.0^{2,7}]trideca-2(7),3,10-trien-5-one
CAS Number: 102518-79-6
Molecular Formula: BH4O3Pb
Molecular Weight: 270.041
MDL Number: MFCD01714949
SMILES: C/C=C/1[C@H]2C=C(C[C@]1(N)c1c(C2)[nH]c(=O)cc1)C

 

Computed Properties
Complexity: 551  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 2  
Heavy Atom Count: 18  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 2  
Undefined Bond Stereocenter Count: 1  

 

 

Upstream Synthesis Route 
  • The compound (5R,9R,11E)-5-Amino-11-ethylidene-5,6,9,10-tetrahydro-7-methyl-5,9-methanocycloocta[b]pyridin-2(1H)-one, commonly known as $name$, is a versatile molecule used in chemical synthesis for its unique properties. In particular, it is valued for its ability to act as a key building block in the creation of various pharmaceuticals, agrochemicals, and specialty chemicals. $name$ plays a crucial role in organic synthesis, enabling the formation of complex molecular structures through its reactive amino and ethylidene groups. Chemists utilize this compound to introduce important functional groups, such as amines and alkylidenes, into target molecules, leading to the creation of diverse chemical entities. Its cycloocta[b]pyridin backbone imparts rigidity and stereochemistry to the synthesized compounds, enhancing their biological activity and stability.In drug discovery, $name$ serves as a valuable intermediate in the synthesis of potential therapeutics, allowing researchers to explore novel chemical space and optimize the properties of lead compounds. Furthermore, its structural features make it an attractive candidate for the development of chiral catalysts and ligands in asymmetric synthesis, enabling the selective formation of enantiomerically pure products.Overall, $name$ is a crucial tool in the arsenal of synthetic chemists, facilitating the construction of intricate molecules with diverse applications in the fields of medicine, agriculture, and material science.
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