CAS 149809-43-8

2,5-Anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-1-(1H-1,2,4-triazol-1-yl)-D-threo-pentitol

Description:

2,5-Anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-1-(1H-1,2,4-triazol-1-yl)-D-threo-pentitol, with CAS number 149809-43-8, is a complex organic compound characterized by its unique structural features. It contains a pentitol backbone, which is a sugar alcohol derivative, and is modified with various functional groups, including a triazole ring and a sulfonyl moiety. The presence of the difluorophenyl group suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals. This compound may exhibit specific biological activities due to its structural components, making it of interest in drug design and synthesis. Its anhydro and deoxy characteristics indicate that it may participate in specific chemical reactions, such as glycosylation or other transformations relevant in organic synthesis. Overall, the compound's intricate structure and functionalization suggest it could have significant implications in both chemical research and practical applications in the pharmaceutical industry.

Formula: C₂₁H₂₁F₂N₃O₄S

InChI: InChI=1S/C21H21F2N3O4S/c1-15-2-5-18(6-3-15)31(27,28)30-11-16-9-21(29-10-16,12-26-14-24-13-25-26)19-7-4-17(22)8-20(19)23/h2-8,13-14,16H,9-12H2,1H3/t16-,21-/m0/s1

InChI key: InChIKey=DFWVLCJRFGIRAK-KKSFZXQISA-N

SMILES: C([C@@]1(C[C@H](COS(=O)(=O)C2=CC=C(C)C=C2)CO1)C3=C(F)C=C(F)C=C3)N4C=NC=N4

Synonyms:

• ((3S,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)-tetrahydrofuran-3-yl)methyl 4-methylbenzenesulfonate
• ((3S,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methyl p-tosylate
• ((3S,5R)-5-((1H-1,2,4-triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methyl4-methylbenzenesulfonate
• (5R-cis)-toluene-4-sulfonic acid 5-(2,4-difluorophenyl)-5-(1H-1,2,4-triazol-1-yl)methyltetrahydrofuran-3-yl methyl ester
• (5R-cis)-toluene-4-sulfonic acid 5-(2,4-difluorophenyl)-5-(1H-1,2,4�Ctriazol-1-yl)methyltetrahydrofuran-3-yl methyl ester
• 2,5-Anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-1-(1H-1,2,4-triazol-1-yl)-<span class="text-smallcaps">D</span>-threo-pentitol
• 2,5-anhydro-1,3,4-trideoxy-2-(2,4-difluorophenyl)-4-({[(4-methylphenyl)sulfonyl]oxy}methyl)-1-(1H-1,2,4-triazol-1-yl)-D-threo-pentitol
• <span class="text-smallcaps">D</span>-threo-Pentitol, 2,5-anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-1-(1H-1,2,4-triazol-1-yl)-
• D-threo-Pentitol, 2,5-anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-1-(1H-1,2,4-triazol-1-yl)-
• 2,5-Anhydro-1,3,4-trideoxy-2-C-(2,4-difluorophenyl)-4-[[[(4-methylphenyl)sulfonyl]oxy]methyl]-1-(1H-1,2,4-triazol-1-yl)-D-threo-pentitol
• (5R-cis)-Toluene-4-sulfonic acid 5-(2,4-difluorophenyl)-5-(1H-1,2,4-triazol-1-yl) methyltetrahydrofuran-3-ylmethyl ester

(3S,5R)-5-(2,4-Difluorophenyl)-5-[(1H-1,2,4-triazol-1-yl)methyl]oxolan-3-ylmethyl p-Toluenesulfonate

CAS: 149809-43-8

Formula: C₂₁H₂₁F₂N₃O₄S

Purity: >98.0%(HPLC)

Color and Shape: White to Orange to Green powder to crystal

Molecular weight: 449.47

Ref: 3B-D4537

((3R,5R)-5-((1H-1,2,4-Triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methyl 4-methylbenzenesulfonate

CAS: 149809-43-8

Formula: C₂₁H₂₁F₂N₃O₄S

Purity: 98%

Color and Shape: Solid

Molecular weight: 449.4709

Ref: IN-DA001M15

((3S,5R)-5-((1H-1,2,4-Triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methyl 4-methylbenzenesulfonate

CAS: 149809-43-8

((3S,5R)-5-((1H-1,2,4-Triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methyl 4-methylbenzenesulfonate

Purity: ≥98%

Molecular weight: 449.47g/mol

Ref: 54-BUP13893

Posaconazole Diastereoisomer Related Compound 8

CAS: 149809-43-8

Formula: C₂₁H₂₁F₂N₃O₄S

Molecular weight: 449.47

Ref: 4Z-P-3888

((3S,5R)-5-((1H-1,2,4-Triazol-1-Yl)Methyl)-5-(2,4-Difluorophenyl)Tetrahydrofuran-3-Yl)Methyl 4-Methylbenzenesulfonate

CAS: 149809-43-8

((3S,5R)-5-((1H-1,2,4-Triazol-1-Yl)Methyl)-5-(2,4-Difluorophenyl)Tetrahydrofuran-3-Yl)Methyl 4-Methylbenzenesulfonate

Purity: 99%

Molecular weight: 449.47g/mol

Ref: 54-PC104915

((3S,5R)-5-((1H-1,2,4-Triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methyl 4-methylbenzenesulfonate

CAS: 149809-43-8

(3S,5R)-5-(1H-1,2,4-Triazole-1-yl)methyl-3-furan antifungal intermediate for posaconazole synthesis with cancer-fighting properties.

Formula: C₂₁H₂₁F₂N₃O₄S

Purity: 98.77%

Color and Shape: Solid

Molecular weight: 449.47

Ref: TM-T64789

(5R-cis)-Toluene-4-sulfonic Acid 5-(2,4-Difluorophenyl)-5-[1,2,4]triazol-1-ylmethyltetrahydrofuran-3-ylmethyl Ester

Controlled Product

CAS: 149809-43-8

Applications Posaconazole intermediate. Antifungal agent.
References Ator, M., et al.: J. Med. Chem., 35, 100 (1992), Andriole, V., et al.: J. Antimicrob. Chemother., 44, 151 (1999), Beuchet, P., et al.: Bioorg. Med. Chem., 9, 1599 (1999),

Formula: C₂₁H₂₁F₂N₃O₄S

Color and Shape: Neat

Molecular weight: 449.47

Ref: TR-T535900

((3S,5R)-5-((1H-1,2,4-Triazol-1-yl)methyl)-5-(2,4-difluorophenyl)tetrahydrofuran-3-yl)methyl 4-methylbenzenesulfonate

CAS: 149809-43-8

Purity: 97%

Color and Shape: Solid

Molecular weight: 449.4700012207031

Ref: 10-F789956

Posaconazole Impurity 29

CAS: 149809-43-8

Formula: C₂₁H₂₁F₂N₃O₄S

Molecular weight: 449.47

Ref: ST-EA-CP-P24047