CAS 869939-83-3

(δS)-δ-Amino-4-[[4-[[[2,4-dichloro-3-[[(2,4-dimethyl-8-quinolinyl)oxy]methyl]phenyl]sulfonyl]amino]tetrahydro-2H-pyran-4-yl]carbonyl]-N,N,N-trimethyl-ε-oxo-1-piperazinepentanaminium

Description:

The chemical substance known as (δS)-δ-Amino-4-[[4-[[[2,4-dichloro-3-[[(2,4-dimethyl-8-quinolinyl)oxy]methyl]phenyl]sulfonyl]amino]tetrahydro-2H-pyran-4-yl]carbonyl]-N,N,N-trimethyl-ε-oxo-1-piperazinepentanaminium, with the CAS number 869939-83-3, is a complex organic compound characterized by its intricate molecular structure. It features multiple functional groups, including amino, sulfonyl, and piperazine moieties, which contribute to its potential biological activity. The presence of a quinoline derivative suggests possible interactions with biological targets, making it of interest in medicinal chemistry. The dichloro and dimethyl substitutions indicate that the compound may exhibit specific electronic and steric properties, influencing its reactivity and solubility. Additionally, the trimethyl and carbonyl groups enhance its polarity, which can affect its pharmacokinetic profile. Overall, this compound's unique characteristics may position it as a candidate for further research in drug development or therapeutic applications, although detailed studies would be necessary to elucidate its specific properties and potential uses.

Formula: C₃₆H₄₉Cl₂N₆O₆S

InChI: InChI=1S/C36H49Cl2N6O6S/c1-24-22-25(2)40-33-26(24)8-6-10-30(33)50-23-27-28(37)11-12-31(32(27)38)51(47,48)41-36(13-20-49-21-14-36)35(46)43-17-15-42(16-18-43)34(45)29(39)9-7-19-44(3,4)5/h6,8,10-12,22,29,41H,7,9,13-21,23,39H2,1-5H3/q+1/t29-/m0/s1

InChI key: InChIKey=FQVSDHOWSLEEKJ-LJAQVGFWSA-N

SMILES: C(=O)(C1(NS(=O)(=O)C2=C(Cl)C(COC=3C4=C(C(C)=CC(C)=N4)C=CC3)=C(Cl)C=C2)CCOCC1)N5CCN(C([C@H](CCC[N+](C)(C)C)N)=O)CC5

Synonyms:

• 1-Piperazinepentanaminium, δ-amino-4-[[4-[[[2,4-dichloro-3-[[(2,4-dimethyl-8-quinolinyl)oxy]methyl]phenyl]sulfonyl]amino]tetrahydro-2H-pyran-4-yl]carbonyl]-N,N,N-trimethyl-ε-oxo-, (δS)-
• (δS)-δ-Amino-4-[[4-[[[2,4-dichloro-3-[[(2,4-dimethyl-8-quinolinyl)oxy]methyl]phenyl]sulfonyl]amino]tetrahydro-2H-pyran-4-yl]carbonyl]-N,N,N-trimethyl-ε-oxo-1-piperazinepentanaminium

Fasitibant

Controlled Product

CAS: 869939-83-3

Formula: C₃₆H₄₉Cl₂N₆O₆S

Color and Shape: Neat

Molecular weight: 764.782

Ref: TR-F869860

Fasitibant

CAS: 869939-83-3

Fasitibant is a potent and selective nonpeptide kinin B2 receptor antagonist.

Formula: C₃₆H₄₉Cl₂N₆O₆S

Color and Shape: Solid

Molecular weight: 764.78

Ref: TM-T68486