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CAS 299181-35-4

:

3-[(Hexahydro-1H-azepin-1-yl)sulfonyl]-4-methoxybenzoic acid

Description:
3-[(Hexahydro-1H-azepin-1-yl)sulfonyl]-4-methoxybenzoic acid, with the CAS number 299181-35-4, is a chemical compound characterized by its unique structural features. It contains a benzoic acid moiety substituted with a methoxy group and a sulfonamide functional group linked to a hexahydro-1H-azepine ring. This compound exhibits properties typical of both aromatic and aliphatic systems, contributing to its potential biological activity. The presence of the sulfonyl group may enhance its solubility and reactivity, while the hexahydro-1H-azepine structure can influence its pharmacokinetic properties. Such compounds are often investigated for their potential therapeutic applications, particularly in medicinal chemistry, due to their ability to interact with biological targets. The specific characteristics, such as melting point, solubility, and stability, would depend on the compound's purity and the conditions under which it is studied. Overall, this compound represents a class of sulfonamide derivatives that may have significant implications in drug development and other chemical applications.
Formula:C14H19NO5S
InChI:InChI=1S/C14H19NO5S/c1-20-12-7-6-11(14(16)17)10-13(12)21(18,19)15-8-4-2-3-5-9-15/h6-7,10H,2-5,8-9H2,1H3,(H,16,17)
InChI key:InChIKey=SSIIBIGRHVVLAP-UHFFFAOYSA-N
SMILES:S(=O)(=O)(C1=C(OC)C=CC(C(O)=O)=C1)N2CCCCCC2
Synonyms:
  • 3-[(Hexahydro-1H-azepin-1-yl)sulfonyl]-4-methoxybenzoic acid
  • Benzoic acid, 3-[(hexahydro-1H-azepin-1-yl)sulfonyl]-4-methoxy-
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