CAS 1985606-14-1

[[(12aR)-12-[(11S)-7,8-Difluoro-6,11-dihydrodibenzo[b,e]thiepin-11-yl]-3,4,6,8,12,12a-hexahydro-6,8-dioxo-1H-[1,4]oxazino[3,4-c]pyrido[2,1-f][1,2,4]triazin-7-yl]oxy]methyl methyl carbonate

Description:

The chemical substance with the name "[[(12aR)-12-[(11S)-7,8-Difluoro-6,11-dihydrodibenzo[b,e]thiepin-11-yl]-3,4,6,8,12,12a-hexahydro-6,8-dioxo-1H-[1,4]oxazino[3,4-c]pyrido[2,1-f][1,2,4]triazin-7-yl]oxy]methyl methyl carbonate" and CAS number "1985606-14-1" is a complex organic compound characterized by its intricate molecular structure, which includes multiple functional groups and stereocenters. This substance features a carbonate moiety, indicating potential reactivity and applications in medicinal chemistry, particularly in the development of pharmaceuticals. The presence of fluorine atoms suggests enhanced biological activity and lipophilicity, which can influence the compound's pharmacokinetics and pharmacodynamics. The compound's structure also includes a bicyclic system and various heterocycles, which are often associated with diverse biological properties. Its stereochemistry, denoted by specific configurations, may play a crucial role in its interaction with biological targets. Overall, this compound exemplifies the complexity often found in drug design, where structural features are meticulously tailored to achieve desired therapeutic effects.

Formula: C₂₇H₂₃F₂N₃O₇S

InChI: InChI=1S/C27H23F2N3O7S/c1-36-27(35)39-14-38-25-19(33)8-9-31-24(25)26(34)30-10-11-37-12-21(30)32(31)23-15-6-7-18(28)22(29)17(15)13-40-20-5-3-2-4-16(20)23/h2-9,21,23H,10-14H2,1H3/t21-,23+/m1/s1

InChI key: InChIKey=RZVPBGBYGMDSBG-GGAORHGYSA-N

SMILES: O(COC(OC)=O)C1=C2N(N([C@]3(N(C2=O)CCOC3)[H])[C@H]4C=5C(CSC=6C4=CC=CC6)=C(F)C(F)=CC5)C=CC1=O

Synonyms:

• ({(12aR)-12-[(11S)-7,8-difluoro-6,11-dihydrodibenzo[b,e]thiepin-11-yl]-6,8-dioxo-3,4,6,8,12,12a-hexahydro-1H-[1,4]oxazino[3,4-c]pyrido[2,1-f][1,2,4]triazin-7-yl}oxy)methyl methyl carbonate
• Baloxavirmarboxil
• [[(12aR)-12-[(11S)-7,8-Difluoro-6,11-dihydrodibenzo[b,e]thiepin-11-yl]-3,4,6,8,12,12a-hexahydro-6,8-dioxo-1H-[1,4]oxazino[3,4-c]pyrido[2,1-f][1,2,4]triazin-7-yl]oxy]methyl methyl carbonate
• Carbonic acid, [[(12aR)-12-[(11S)-7,8-difluoro-6,11-dihydrodibenzo[b,e]thiepin-11-yl]-3,4,6,8,12,12a-hexahydro-6,8-dioxo-1H-[1,4]oxazino[3,4-c]pyrido[2,1-f][1,2,4]triazin-7-yl]oxy]methyl methyl ester
• S 033188
• Baloxavir marboxil

Baloxavir marboxil

CAS: 1985606-14-1

Baloxavir marboxil

Purity: ≥98%

Molecular weight: 571.55g/mol

Ref: 54-BUP15769

Baloxavir Marboxil

CAS: 1985606-14-1

Formula: C₂₇H₂₃F₂N₃O₇S

Color and Shape: Pale Orange Solid

Molecular weight: 571.55

Ref: 4Z-B-192001

Baloxavir Marboxil-d5

CAS: 1985606-14-1

Formula: C₂₇H₁₈D₅F₂N₃O₇S

Molecular weight: 576.58

Ref: 4Z-B-192007

Baloxavir marboxil

CAS: 1985606-14-1

Baloxavir marboxil (S-033188) is a novel cap-dependent endonuclease inhibitor for the treatment of influenza A and B virus infections.

Formula: C₂₇H₂₃F₂N₃O₇S

Purity: 99.6% - 99.89%

Color and Shape: Solid

Molecular weight: 571.55

Ref: TM-T6195

Baloxavir marboxil

CAS: 1985606-14-1

Baloxavir marboxil is a selective inhibitor of the cap-dependent endonuclease of RNA polymerase, an acidic protein in influenza A and B viruses. In patients, baloxavir marboxil reduces the time to recovery by alleviating the symptoms of the influenza A and B infection, in both adults and children.

Formula: C₂₇H₂₃F₂N₃O₇S

Purity: Min. 95%

Color and Shape: Powder

Molecular weight: 571.55 g/mol

Ref: 3D-AB176625

Baloxavir Marboxil

Controlled Product

CAS: 1985606-14-1

Formula: C₂₇H₂₃F₂N₃O₇S

Color and Shape: Neat

Molecular weight: 571.55

Ref: TR-B116325