CAS 1152311-62-0

1-(2,2-Difluoro-1,3-benzodioxol-5-yl)-N-[1-[(2R)-2,3-dihydroxypropyl]-6-fluoro-2-(2-hydroxy-1,1-dimethylethyl)-1H-indol-5-yl]cyclopropanecarboxamide

Description:

The chemical substance known as "1-(2,2-Difluoro-1,3-benzodioxol-5-yl)-N-[1-[(2R)-2,3-dihydroxypropyl]-6-fluoro-2-(2-hydroxy-1,1-dimethylethyl)-1H-indol-5-yl]cyclopropanecarboxamide," with the CAS number 1152311-62-0, is a complex organic compound characterized by its unique structural features, including a cyclopropanecarboxamide moiety and multiple fluorinated and hydroxylated groups. This compound is likely to exhibit significant biological activity due to its intricate arrangement of functional groups, which may influence its interactions with biological targets. The presence of fluorine atoms typically enhances lipophilicity and metabolic stability, while hydroxyl groups can increase solubility and hydrogen bonding potential. The benzodioxole and indole components suggest potential applications in medicinal chemistry, possibly as a pharmaceutical agent. Its synthesis and characterization would involve advanced organic chemistry techniques, and its properties, such as solubility, stability, and reactivity, would be critical for understanding its potential applications in drug development or other fields. Further studies would be necessary to elucidate its specific biological activities and mechanisms of action.

Formula: C₂₆H₂₇F₃N₂O₆

InChI: InChI=1S/C26H27F3N2O6/c1-24(2,13-33)22-8-14-7-18(17(27)10-19(14)31(22)11-16(34)12-32)30-23(35)25(5-6-25)15-3-4-20-21(9-15)37-26(28,29)36-20/h3-4,7-10,16,32-34H,5-6,11-13H2,1-2H3,(H,30,35)/t16-/m1/s1

InChI key: InChIKey=MJUVRTYWUMPBTR-MRXNPFEDSA-N

SMILES: C(NC=1C=C2C(=CC1F)N(C[C@H](CO)O)C(C(CO)(C)C)=C2)(=O)C3(CC3)C=4C=C5C(=CC4)OC(F)(F)O5

Synonyms:

• (R)-1-(2,2-Difluorobenzo[D] [1,3]Dioxol-5-Yl)-N-(1-(2,3-Dihydroxypropyl)-6-Fluoro-2-(1-Hydroxy-2-Methylpropan-2-Yl)-1H-Indol-5-Yl) Cyclopropanecarboxamide
• 1-(2,2-Difluoro-1,3-benzodioxol-5-yl)-N-[1-[(2R)-2,3-dihydroxypropyl]-6-fluoro-2-(2-hydroxy-1,1-dimethylethyl)-1H-indol-5-yl]cyclopropanecarboxamide
• 1-(2,2-Difluoro-1,3-benzodioxol-5-yl)-N-{1-[(2R)-2,3-dihydroxypropyl]-6-fluoro-2-(1-hydroxy-2-methyl-2-propanyl)-1H-indol-5-yl}cyclopropanecarboxamide
• Cs-1078
• Cyclopropanecarboxamide, 1-(2,2-Difluoro-1,3-Benzodioxol-5-Yl)-N-[1-[(2R)-2,3-Dihydroxypropyl]-6-Fluoro-2-(2-Hydroxy-1,1-Dimethylethyl)-1H-Indol-5-Yl]-
• Tezacaftor
• VX 661

1-(2,2-difluoro-1,3-benzodioxol-5-yl)-N-{1-[(2R)-2,3-dihydroxypropyl]-6-fluoro-2-(1-hydroxy-2-methylpropan-2-yl)indol-5-yl}cyclopropane-1-carboxamide

CAS: 1152311-62-0

Formula: C₂₆H₂₇F₃N₂O₆

Purity: 99%

Color and Shape: Solid

Molecular weight: 520.4976

Ref: IN-DA000GHO

Tezacaftor (VX-661)

CAS: 1152311-62-0

Formula: C₂₆H₂₇F₃N₂O₆

Molecular weight: 520.51

Ref: 4Z-T-303001

(R)-1-(2,2-Difluorobenzo[D][1,3]Dioxol-5-Yl)-N-(1-(2,3-Dihydroxypropyl)-6-Fluoro-2-(1-Hydroxy-2-Methylpropan-2-Yl)-1H-Indol-5-Yl)Cyclopropanecarboxamide

CAS: 1152311-62-0

(R)-1-(2,2-Difluorobenzo[D][1,3]Dioxol-5-Yl)-N-(1-(2,3-Dihydroxypropyl)-6-Fluoro-2-(1-Hydroxy-2-Methylpropan-2-Yl)-1H-Indol-5-Yl)Cyclopropanecarboxamide

Purity: 99%

Molecular weight: 520.5g/mol

Ref: 54-PC108640

Tezacaftor

CAS: 1152311-62-0

Tezacaftor

Purity: ≥98%

Molecular weight: 520.5g/mol

Ref: 54-BUP03616

Tezacaftor

CAS: 1152311-62-0

Color and Shape: Neat

Ref: 86-MM3968.00

Tezacaftor

CAS: 1152311-62-0

Tezacaftor (VX661) is a small molecule that can be used as a corrector of the cystic fibrosis transmembrane conductance regulator (CFTR) gene function.

Formula: C₂₆H₂₇F₃N₂O₆

Purity: 98.84% - >99.99%

Color and Shape: Solid

Molecular weight: 520.5

Ref: TM-T2263

Tezacaftor-D4

Controlled Product

CAS: 1152311-62-0

Formula: C₂₆D₄H₂₃F₃N₂O₆

Color and Shape: Neat

Molecular weight: 524.52

Ref: TR-T321512

Tezacaftor

CAS: 1152311-62-0

Applications Tezacaftor is used as a combination therapy with Ivacaftor for the treatment of patients with cystic fibrosis.
References Rowe, S. M., et al.: N. Engl. J. Med., 377, 2024 (2017); Dhooghe, B., et al.: Exp. Opin. Investig. Drugs, 25, 423 (2016)

Formula: C₂₆H₂₇F₃N₂O₆

Color and Shape: White To Light Yellow

Molecular weight: 520.5

Ref: TR-T321510

Tezacaftor

CAS: 1152311-62-0

Potentiates cystic fibrosis transmembrane conductance regulator (CFTR)

Formula: C₂₆H₂₇F₃N₂O₆

Purity: Min. 95%

Color and Shape: White Powder

Molecular weight: 520.5 g/mol

Ref: 3D-FD104056