CAS 144092-31-9

4-[(1E)-2-[7-(Heptyloxy)-3,4-dihydro-4,4-dimethyl-1,1-dioxido-2H-1-benzothiopyran-6-yl]-1-propen-1-yl]benzoic acid

Description:

The chemical substance known as 4-[(1E)-2-[7-(Heptyloxy)-3,4-dihydro-4,4-dimethyl-1,1-dioxido-2H-1-benzothiopyran-6-yl]-1-propen-1-yl]benzoic acid, with the CAS number 144092-31-9, is a complex organic compound characterized by its unique structural features. It contains a benzoic acid moiety, which contributes to its acidity and potential reactivity. The presence of a heptyloxy group suggests that it has hydrophobic characteristics, which may influence its solubility and interaction with biological membranes. The compound also features a benzothiopyran structure, indicating potential applications in medicinal chemistry, particularly in the development of pharmaceuticals. The dioxido group implies the presence of oxygen functionalities that may enhance its reactivity or stability. Overall, this compound's intricate structure may confer specific biological activities, making it of interest in various fields, including organic synthesis and drug development. However, detailed studies would be necessary to fully understand its properties and potential applications.

Formula: C₂₈H₃₆O₅S

InChI: InChI=1S/C28H36O5S/c1-5-6-7-8-9-15-33-25-19-26-24(28(3,4)14-16-34(26,31)32)18-23(25)20(2)17-21-10-12-22(13-11-21)27(29)30/h10-13,17-19H,5-9,14-16H2,1-4H3,(H,29,30)/b20-17+

InChI key: InChIKey=JEIWQRITHXYGIF-LVZFUZTISA-N

SMILES: O=S1(=O)C=2C(=CC(\C(=C\C3=CC=C(C(O)=O)C=C3)\C)=C(OCCCCCCC)C2)C(C)(C)CC1

Synonyms:

• Benzoic acid, 4-[(1E)-2-[7-(heptyloxy)-3,4-dihydro-4,4-dimethyl-1,1-dioxido-2H-1-benzothiopyran-6-yl]-1-propenyl]-
• Benzoic acid, 4-[2-[7-(heptyloxy)-3,4-dihydro-4,4-dimethyl-2H-1-benzothiopyran-6-yl]-1-propenyl]-, S,S-dioxide, (E)-
• 4-[(1E)-2-[7-(Heptyloxy)-3,4-dihydro-4,4-dimethyl-1,1-dioxido-2H-1-benzothiopyran-6-yl]-1-propen-1-yl]benzoic acid
• Benzoic acid, 4-[(1E)-2-[7-(heptyloxy)-3,4-dihydro-4,4-dimethyl-1,1-dioxido-2H-1-benzothiopyran-6-yl]-1-propen-1-yl]-
• 2H-1-Benzothiopyran, benzoic acid deriv.

Ro 41-5253

CAS: 144092-31-9

Formula: C₂₈H₃₆O₅S

Purity: 95%

Molecular weight: 484.6474

Ref: IN-DA00ATF5

Ro 41-5253

CAS: 144092-31-9

Ro 41-5253

Purity: ≥98%

Molecular weight: 484.65g/mol

Ref: 54-BUP21808

Ro 41-5253

CAS: 144092-31-9

Ro 41-5253 is a RARα antagonist with antitumor activity that inhibits the proliferation of ZR-75.1 estrogen receptor-positive breast cancer cells.

Formula: C₂₈H₃₆O₅S

Purity: 98%

Color and Shape: Solid

Molecular weight: 484.65

Ref: TM-T28589