CAS 355025-24-0: 3-[[[4-[4-[[[1-(2-Chlorophenyl)ethoxy]carbonyl]amino]-3-methyl-5-isoxazolyl]phenyl]methyl]thio]propanoic acid

Description: The chemical substance known as 3-[[[4-[4-[[[1-(2-Chlorophenyl)ethoxy]carbonyl]amino]-3-methyl-5-isoxazolyl]phenyl]methyl]thio]propanoic acid, with the CAS number 355025-24-0, is a complex organic compound characterized by its multi-functional structure. It features a propanoic acid backbone, which is a carboxylic acid, indicating potential acidic properties. The presence of a thioether linkage suggests that it may exhibit unique reactivity and solubility characteristics. Additionally, the compound contains an isoxazole ring, which is known for its biological activity, potentially contributing to pharmacological properties. The chlorophenyl and ethoxy groups enhance its lipophilicity, possibly influencing its interaction with biological membranes. Overall, this compound's intricate structure suggests it may be of interest in medicinal chemistry, particularly in the development of therapeutic agents, although specific biological activities would require empirical investigation. Its synthesis and characterization would involve standard organic chemistry techniques, including functional group transformations and purification methods.

Formula: C₂₃H₂₃ClN₂O₅S

InChI: InChI=1S/C23H23ClN2O5S/c1-14-21(25-23(29)30-15(2)18-5-3-4-6-19(18)24)22(31-26-14)17-9-7-16(8-10-17)13-32-12-11-20(27)28/h3-10,15H,11-13H2,1-2H3,(H,25,29)(H,27,28)

InChI key: InChIKey=LLIFMNUXGDHTRO-UHFFFAOYSA-N

SMILES: O=C(OC(C=1C=CC=CC1Cl)C)NC2=C(ON=C2C)C=3C=CC(=CC3)CSCCC(=O)O

Synonyms:

• Propanoic acid, 3-[[[4-[4-[[[1-(2-chlorophenyl)ethoxy]carbonyl]amino]-3-methyl-5-isoxazolyl]phenyl]methyl]thio]-
• Ki 16425
• 3-[[4-[4-[1-(2-Chlorophenyl)ethoxycarbonylamino]-3-methyl-1,2-oxazol-5-yl]phenyl]methylsulfanyl]propanoic acid
• 3-[[[4-[4-[[[1-(2-Chlorophenyl)ethoxy]carbonyl]amino]-3-methyl-5-isoxazolyl]phenyl]methyl]thio]propanoic acid

KI16425

CAS: 355025-24-0

• Formula: C₂₃H₂₃ClN₂O₅S
• Purity: %
• Color and Shape: Solid
• Molecular weight: 474.9571

Ki16425

CAS: 355025-24-0

• Molecular weight: 474.96g/mol

Ki16425

CAS: 355025-24-0

• Purity: ≥95%
• Molecular weight: 474.96g/mol

Ki16425

CAS: 355025-24-0

Ki16425 (Debio 0719) is a competitive, potent and reversible antagonist to LPA1, LPA2 and LPA3 …

• Formula: C₂₃H₂₃ClN₂O₅S
• Purity: 97.60% - 97.78%
• Color and Shape: Solid
• Molecular weight: 474.96

Ki16425

CAS: 355025-24-0

Applications Ki16425 is a competitive, potent and reversible antagonist to LPA1, LPA2 and LPA3. References …

• Formula: C₂₃H₂₃ClN₂O₅S
• Color and Shape: Neat
• Molecular weight: 474.957

3-[[[4-[4-[[[1-(2-Chlorophenyl)ethoxy]carbonyl]amino]-3-methyl-5-isoxazolyl]phenyl]methyl]thio]-propanoic acid

CAS: 355025-24-0

3-[[[4-[4-[[[1-(2-Chlorophenyl)ethoxy]carbonyl]amino]-3-methyl-5-isoxazolyl]phenyl]methyl]thio]-propanoic acid is a polymerase chain inhibitor that inhibits the activity of DNA polymerases, which …

• Formula: C₂₃H₂₃ClN₂O₅S
• Purity: Min. 95%
• Molecular weight: 474.96 g/mol