CAS 850021-32-8

2-[4-[[[4-(Acetylamino)phenyl]sulfonyl]methylamino]phenoxy]acetic acid

Description:

2-[4-[[[4-(Acetylamino)phenyl]sulfonyl]methylamino]phenoxy]acetic acid, with the CAS number 850021-32-8, is a synthetic organic compound characterized by its complex structure, which includes an acetic acid moiety, a sulfonamide group, and an acetylamino group. This compound typically exhibits properties associated with both acidic and basic functionalities due to the presence of the carboxylic acid group and the amino groups. It is likely to be soluble in polar solvents, such as water and alcohols, owing to its polar functional groups. The sulfonamide group may impart additional stability and influence its biological activity. Such compounds are often investigated for their potential pharmaceutical applications, particularly in the fields of anti-inflammatory or anti-cancer therapies. The presence of multiple aromatic rings suggests potential for π-π stacking interactions, which can be relevant in biological systems. Overall, this compound's unique structural features contribute to its potential utility in medicinal chemistry and drug development.

Formula: C₁₇H₁₈N₂O₆S

InChI: InChI=1S/C17H18N2O6S/c1-12(20)18-13-3-9-16(10-4-13)26(23,24)19(2)14-5-7-15(8-6-14)25-11-17(21)22/h3-10H,11H2,1-2H3,(H,18,20)(H,21,22)

InChI key: InChIKey=GQWFRJIBZFFEJD-UHFFFAOYSA-N

SMILES: N(S(=O)(=O)C1=CC=C(NC(C)=O)C=C1)(C)C2=CC=C(OCC(O)=O)C=C2

Synonyms:

• Acetic acid, [4-[[[4-(acetylamino)phenyl]sulfonyl]methylamino]phenoxy]-
• Acetic acid, 2-[4-[[[4-(acetylamino)phenyl]sulfonyl]methylamino]phenoxy]-
• 2-[4-[[[4-(Acetylamino)phenyl]sulfonyl]methylamino]phenoxy]acetic acid