CAS 1235865-77-6: 4-[4-[[2-(4-Chlorophenyl)-4,4-dimethyl-1-cyclohexen-1-yl]methyl]-1-piperazinyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoic acid
Description:The chemical substance known as 4-[4-[[2-(4-Chlorophenyl)-4,4-dimethyl-1-cyclohexen-1-yl]methyl]-1-piperazinyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoic acid, with the CAS number 1235865-77-6, is a complex organic compound characterized by its multi-functional structure. It features a benzoic acid moiety, which is a common structural element in pharmaceuticals, indicating potential biological activity. The presence of a piperazine ring suggests possible interactions with neurotransmitter receptors, making it of interest in medicinal chemistry. Additionally, the chlorophenyl and pyrrolo[2,3-b]pyridine groups may contribute to its lipophilicity and overall pharmacokinetic properties. The compound's cyclohexene component adds to its structural diversity, potentially influencing its reactivity and binding affinity in biological systems. Overall, this substance may exhibit unique pharmacological properties, warranting further investigation for therapeutic applications, particularly in areas related to neuropharmacology or oncology. However, specific biological activity and safety profiles would require empirical studies to elucidate its potential uses.
Formula:C33H35ClN4O3
InChI:InChI=1S/C33H35ClN4O3/c1-33(2)11-9-24(29(19-33)22-3-5-25(34)6-4-22)21-37-13-15-38(16-14-37)26-7-8-28(32(39)40)30(18-26)41-27-17-23-10-12-35-31(23)36-20-27/h3-8,10,12,17-18,20H,9,11,13-16,19,21H2,1-2H3,(H,35,36)(H,39,40)
InChI key:InChIKey=DMRMYQUGHOAQFW-UHFFFAOYSA-N
SMILES:O=C(O)C1=CC=C(C=C1OC=2C=NC=3NC=CC3C2)N4CCN(CC5=C(C=6C=CC(Cl)=CC6)CC(C)(C)CC5)CC4
- Synonyms:
- 2-[(1H-Pyrrolo[2,3-b]pyridin-5-yl)oxy]-4-[4-[[2-(4-chlorophenyl)-4,4-dimethylcyclohex-1-enyl]methyl]piperazin-1-yl]benzoic acid
- 4-[4-[[2-(4-Chlorophenyl)-4,4-dimethyl-1-cyclohexen-1-yl]methyl]-1-piperazinyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)benzoic acid
- Benzoic acid, 4-[4-[[2-(4-chlorophenyl)-4,4-dimethyl-1-cyclohexen-1-yl]methyl]-1-piperazinyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)-
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Benzoic acid, 4-[4-[[2-(4-chlorophenyl)-4,4-dimethyl-1-cyclohexen-1-yl]methyl]-1-piperazinyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yloxy)-
Ref: IN-DA000KTW
1g | 64.00 € | ||
5g | 184.00 € | ||
25g | 610.00 € | ||
100mg | 26.00 € | ||
250mg | 36.00 € |
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2-[(1H-Pyrrolo[2,3-b]pyridin-5-yl)oxy]-4-[4-[[2-(4-chlorophenyl)-4,4-dimethylcyclohex-1-enyl]methyl]piperazin-1-yl]benzoic acid
Ref: 54-OR90791
5g | 272.00 € | ||
25g | 1,177.00 € |
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2-[(1H-Pyrrolo[2,3-b]pyridin-5-yl)oxy]-4-[4-[[2-(4-chlorophenyl)-4,4-dimethylcyclohex-1-enyl]methyl]piperazin-1-yl]benzoic acid
Ref: 10-F790356
1g | 38.00 € | ||
5g | 158.00 € | ||
25g | 685.00 € | ||
250mg | 20.00 € |
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Venetoclax Impurity S1
Controlled ProductRef: TR-V121045
1g | 1,136.00 € |
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2-((1H-Pyrrolo[2,3-b]pyridin-5-yl)oxy)-4-(4-((4'-chloro-5,5-dimethyl-3,4,5,6-tetrahydro-[1,1'-biphenyl]-2-yl)methyl)piperazin-1-yl)b enzoic acid
Ref: 3D-KZB86577
10g | 732.00 € | ||
25g | 1,064.00 € |