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Home  > Inhibitors/Agonists  > Apoptosis  > Bcl-2  > 4-(4-{[2-(4-chlorophenyl)-4,4-dimethylcyclohex-1-en-1-yl]methyl}piperazin-1-yl)-N-({3-nitro-4-[(oxan-4-ylmethyl)amino]benzene}sulfonyl)-2-{1H-pyrrolo[2,3-b]pyridin-5-yloxy}benzamide

AA31582

1257044-40-8 | 4-(4-{[2-(4-chlorophenyl)-4,4-dimethylcyclohex-1-en-1-yl]methyl}piperazin-1-yl)-N-({3-nitro-4-[(oxan-4-ylmethyl)amino]benzene}sulfonyl)-2-{1H-pyrrolo[2,3-b]pyridin-5-yloxy}benzamide

Packsize Purity Availability Price Discounted Price    Quantity
5mg 97% in stock $10.00 $7.00 -   +
50mg 97% in stock $32.00 $22.00 -   +
100mg 97% in stock $52.00 $36.00 -   +
250mg 97% in stock $56.00 $39.00 -   +
1g 97% in stock $109.00 $76.00 -   +
5g 97% in stock $511.00 $358.00 -   +
10g 97% in stock $946.00 $662.00 -   +
25g 97% in stock $1,879.00 $1,316.00 -   +
100g 97% in stock $5,609.00 $3,927.00 -   +

*All products are for research use only and not intended for human or animal use.

*All prices are in USD.

Description
Catalog Number: AA31582
Chemical Name: 4-(4-{[2-(4-chlorophenyl)-4,4-dimethylcyclohex-1-en-1-yl]methyl}piperazin-1-yl)-N-({3-nitro-4-[(oxan-4-ylmethyl)amino]benzene}sulfonyl)-2-{1H-pyrrolo[2,3-b]pyridin-5-yloxy}benzamide
CAS Number: 1257044-40-8
Molecular Formula: C45H50ClN7O7S
Molecular Weight: 868.4392
MDL Number: MFCD23160052
SMILES: Clc1ccc(cc1)C1=C(CCC(C1)(C)C)CN1CCN(CC1)c1ccc(c(c1)Oc1cnc2c(c1)cc[nH]2)C(=O)NS(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])NCC1CCOCC1

 

Computed Properties
Complexity: 1640  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 61  
Hydrogen Bond Acceptor Count: 11  
Hydrogen Bond Donor Count: 3  
Rotatable Bond Count: 12  
XLogP3: 8.2  

 

 

Upstream Synthesis Route
  • The compound $name$ can be utilized in chemical synthesis as a versatile building block for creating novel pharmaceutical compounds. Its unique structure, consisting of a complex array of aromatic rings and functional groups, provides a solid foundation for the synthesis of diverse organic molecules. By incorporating $name$ into synthetic pathways, chemists can access a wide range of derivatives with potential applications in drug discovery and development. This compound's structural complexity and functional diversity make it a valuable tool for designing and synthesizing new chemical entities with enhanced pharmacological properties.
Literature
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