CAS 1799633-27-4

(αR)-α-[[(5S)-5-[3-Chloro-2-methyl-4-[2-(4-methyl-1-piperazinyl)ethoxy]phenyl]-6-(5-fluoro-2-furanyl)thieno[2,3-d]pyrimidin-4-yl]oxy]-2-[[1-(2,2,2-trifluoroethyl)-1H-pyrazol-5-yl]methoxy]benzenepropanoic acid

Description:

The chemical substance with the name "(αR)-α-[[[5S)-5-[3-Chloro-2-methyl-4-[2-(4-methyl-1-piperazinyl)ethoxy]phenyl]-6-(5-fluoro-2-furanyl)thieno[2,3-d]pyrimidin-4-yl]oxy]-2-[[1-(2,2,2-trifluoroethyl)-1H-pyrazol-5-yl]methoxy]benzenepropanoic acid" and CAS number "1799633-27-4" is a complex organic compound characterized by its multi-functional structure, which includes various heterocycles and functional groups. This compound features a thieno[2,3-d]pyrimidine core, which is known for its biological activity, particularly in medicinal chemistry. The presence of a chloro group, a trifluoroethyl moiety, and a piperazine ring suggests potential interactions with biological targets, making it of interest in pharmaceutical research. Additionally, the compound's structure indicates it may exhibit lipophilicity due to the presence of aromatic rings and alkyl substituents, which can influence its solubility and permeability. Overall, this substance is likely to be investigated for its pharmacological properties, including potential anti-inflammatory or anticancer activities, although specific biological data would be necessary to confirm its efficacy and safety profile.

Formula: C₃₉H₃₇ClF₄N₆O₆S

InChI: InChI=1S/C39H37ClF4N6O6S/c1-23-26(7-8-28(34(23)40)53-18-17-49-15-13-48(2)14-16-49)32-33-36(45-22-46-37(33)57-35(32)29-9-10-31(41)55-29)56-30(38(51)52)19-24-5-3-4-6-27(24)54-20-25-11-12-47-50(25)21-39(42,43)44/h3-12,22,30H,13-21H2,1-2H3,(H,51,52)

InChI key: InChIKey=ZFBHXVOCZBPADE-UHFFFAOYSA-N

SMILES: O(C(CC1=C(OCC=2N(CC(F)(F)F)N=CC2)C=CC=C1)C(O)=O)C3=C4C(=C(SC4=NC=N3)C5=CC=C(F)O5)C6=C(C)C(Cl)=C(OCCN7CCN(C)CC7)C=C6

Synonyms:

• Benzenepropanoic acid, α-[[(5S)-5-[3-chloro-2-methyl-4-[2-(4-methyl-1-piperazinyl)ethoxy]phenyl]-6-(5-fluoro-2-furanyl)thieno[2,3-d]pyrimidin-4-yl]oxy]-2-[[1-(2,2,2-trifluoroethyl)-1H-pyrazol-5-yl]methoxy]-, (αR)-
• S 63845
• (αR)-α-[[(5S)-5-[3-Chloro-2-methyl-4-[2-(4-methyl-1-piperazinyl)ethoxy]phenyl]-6-(5-fluoro-2-furanyl)thieno[2,3-d]pyrimidin-4-yl]oxy]-2-[[1-(2,2,2-trifluoroethyl)-1H-pyrazol-5-yl]methoxy]benzenepropanoic acid
• S-63845

Benzenepropanoic acid, α-[[(5S)-5-[3-chloro-2-methyl-4-[2-(4-methyl-1-piperazinyl)ethoxy]phenyl]-6-(5-fluoro-2-furanyl)thieno[2,3-d]pyrimidin-4-yl]oxy]-2-[[1-(2,2,2-trifluoroethyl)-1H-pyrazol-5-yl]methoxy]-, (αR)-

CAS: 1799633-27-4

Formula: C₃₉H₃₇ClF₄N₆O₆S

Purity: 98%

Color and Shape: Solid

Molecular weight: 829.2593

Ref: IN-DA0021IR

S63845

CAS: 1799633-27-4

S63845

Purity: ≥95%

Molecular weight: 829.26g/mol

Ref: 54-BUP01542

S63845

CAS: 1799633-27-4

S63845

Purity: 98%

Color and Shape: Solid

Molecular weight: 829.26g/mol

Ref: 54-BISN0043

S63845

CAS: 1799633-27-4

S63845 is a selective myeloid leukemia 1（MCL1) inhibitor that binds to human MCL1 with a Kd of 0.19 nM.Cost-effective and quality-assured.

Formula: C₃₉H₃₇ClF₄N₆O₆S

Purity: 97.7% - ≥98%

Color and Shape: Solid

Molecular weight: 829.26

Ref: TM-T5346

S 63845

CAS: 1799633-27-4

S 63845 is a novel anti-cancer drug that belongs to the class of ubiquitin ligases. It has been shown to induce apoptosis in cancer cells and inhibit tumor growth in vivo. S 63845 also inhibits the phosphorylation of cyclin D2, which may be a potential biomarker for sclerosing cholangitis (SCC). This compound is highly cytotoxic and has been found to be effective against subcutaneous tumors in mice. S 63845 also inhibits the proliferation of primary cells and has been shown to significantly reduce hepatic steatosis, as well as inhibiting inflammation caused by toll-like receptor 4 activation.

Formula: C₃₉H₃₇ClF₄N₆O₆S

Purity: Min. 95%

Color and Shape: Solid

Molecular weight: 829.26 g/mol

Ref: 3D-BS166833