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CAS 199191-67-8

:

2-[[Methyl[(3S)-3-(1-naphthalenyloxy)-3-(2-thienyl)propyl]amino]carbonyl]benzoic acid

Description:
The chemical substance known as 2-[[Methyl[(3S)-3-(1-naphthalenyloxy)-3-(2-thienyl)propyl]amino]carbonyl]benzoic acid, with the CAS number 199191-67-8, is a complex organic compound characterized by its multi-functional structure. It features a benzoic acid moiety, which contributes to its acidity and potential for forming salts. The presence of a methyl group and an amino group indicates that it may exhibit basic properties, allowing for interactions with various biological targets. The compound also contains a naphthalenyloxy group and a thienyl group, which can enhance its lipophilicity and influence its pharmacokinetic properties. These structural elements suggest that it may have applications in medicinal chemistry, potentially acting as a pharmaceutical agent. The stereochemistry indicated by the (3S) configuration suggests specific spatial arrangements that could be crucial for its biological activity. Overall, this compound's unique combination of functional groups and stereochemistry may contribute to its potential efficacy in therapeutic applications.
Formula:C26H23NO4S
InChI:InChI=1S/C26H23NO4S/c1-27(25(28)20-11-4-5-12-21(20)26(29)30)16-15-23(24-14-7-17-32-24)31-22-13-6-9-18-8-2-3-10-19(18)22/h2-14,17,23H,15-16H2,1H3,(H,29,30)/t23-/m0/s1
InChI key:InChIKey=QYWSULHSCQVWPV-QHCPKHFHSA-N
SMILES:O([C@@H](CCN(C(=O)C1=C(C(O)=O)C=CC=C1)C)C2=CC=CS2)C=3C4=C(C=CC3)C=CC=C4
Synonyms:
  • Benzoic acid, 2-[[methyl[(3S)-3-(1-naphthalenyloxy)-3-(2-thienyl)propyl]amino]carbonyl]-
  • 2-[[Methyl[(3S)-3-(1-naphthalenyloxy)-3-(2-thienyl)propyl]amino]carbonyl]benzoic acid
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