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CAS 136668-50-3

:

1-[(4-Chlorophenyl)methyl]-3-(3,3-dimethyl-1-oxobutyl)-α,α-dimethyl-5-(2-quinolinylmethoxy)-1H-indole-2-propanoic acid

Description:
The chemical substance known as 1-[(4-Chlorophenyl)methyl]-3-(3,3-dimethyl-1-oxobutyl)-α,α-dimethyl-5-(2-quinolinylmethoxy)-1H-indole-2-propanoic acid, with the CAS number 136668-50-3, is a complex organic compound characterized by its indole structure, which is a bicyclic compound containing a benzene ring fused to a pyrrole ring. This substance features multiple functional groups, including a propanoic acid moiety, which contributes to its potential biological activity. The presence of a chlorophenyl group and a quinolinylmethoxy group suggests that it may exhibit specific interactions with biological targets, possibly influencing its pharmacological properties. The compound's structure indicates it may have lipophilic characteristics due to the presence of multiple aromatic rings and alkyl groups, which can affect its solubility and permeability in biological systems. Overall, this compound may be of interest in medicinal chemistry for its potential therapeutic applications, although specific biological activities and mechanisms would require further investigation.
Formula:C36H37ClN2O4
InChI:InChI=1S/C36H37ClN2O4/c1-35(2,3)20-32(40)33-28-18-27(43-22-26-15-12-24-8-6-7-9-29(24)38-26)16-17-30(28)39(21-23-10-13-25(37)14-11-23)31(33)19-36(4,5)34(41)42/h6-18H,19-22H2,1-5H3,(H,41,42)
InChI key:InChIKey=IUHIISLXVJPCRU-UHFFFAOYSA-N
SMILES:C(CC(C)(C)C)(=O)C=1C=2C(N(CC3=CC=C(Cl)C=C3)C1CC(C(O)=O)(C)C)=CC=C(OCC4=NC5=C(C=C4)C=CC=C5)C2
Synonyms:
  • L 689037
  • 1-[(4-Chlorophenyl)methyl]-3-(3,3-dimethyl-1-oxobutyl)-α,α-dimethyl-5-(2-quinolinylmethoxy)-1H-indole-2-propanoic acid
  • 1H-Indole-2-propanoic acid, 1-[(4-chlorophenyl)methyl]-3-(3,3-dimethyl-1-oxobutyl)-α,α-dimethyl-5-(2-quinolinylmethoxy)-
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