CAS 849675-88-3

4H-1-Benzopyran-2-carboxamide, N-[2-[2-[4-[2-(3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)ethyl]phenyl]-2H-tetrazol-5-yl]-4,5-dimethoxyphenyl]-4-oxo-, hydrochloride (1:1)

Description:

4H-1-Benzopyran-2-carboxamide, N-[2-[2-[4-[2-(3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)ethyl]phenyl]-2H-tetrazol-5-yl]-4,5-dimethoxyphenyl]-4-oxo-, hydrochloride (1:1), with CAS number 849675-88-3, is a complex organic compound characterized by its multi-functional structure, which includes a benzopyran core, a carboxamide group, and various substituents such as dimethoxy and tetrazole moieties. This compound is typically synthesized for research purposes and may exhibit biological activity, potentially influencing various biochemical pathways. Its hydrochloride form indicates that it is a salt, which can enhance its solubility in aqueous solutions, making it suitable for pharmacological studies. The presence of multiple aromatic rings and heterocycles suggests potential interactions with biological targets, which could be of interest in medicinal chemistry. However, specific properties such as solubility, melting point, and biological activity would require empirical data for precise characterization. As with many synthetic compounds, safety and handling precautions should be observed due to potential toxicity or reactivity.

Formula: C₃₈H₃₆N₆O₇·ClH

InChI: InChI=1S/C38H36N6O7.ClH/c1-47-32-17-24-14-16-43(22-25(24)18-33(32)48-2)15-13-23-9-11-26(12-10-23)44-41-37(40-42-44)28-19-34(49-3)35(50-4)20-29(28)39-38(46)36-21-30(45)27-7-5-6-8-31(27)51-36;/h5-12,17-21H,13-16,22H2,1-4H3,(H,39,46);1H

InChI key: InChIKey=KAQQJKZDBBMBEZ-UHFFFAOYSA-N

SMILES: N(C(=O)C=1OC=2C(C(=O)C1)=CC=CC2)C3=C(C=C(OC)C(OC)=C3)C4=NN(N=N4)C5=CC=C(CCN6CC=7C(CC6)=CC(OC)=C(OC)C7)C=C5.Cl

Synonyms:

• 4H-1-Benzopyran-2-carboxamide, N-[2-[2-[4-[2-(3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)ethyl]phenyl]-2H-tetrazol-5-yl]-4,5-dimethoxyphenyl]-4-oxo-, monohydrochloride
• 4H-1-Benzopyran-2-carboxamide, N-[2-[2-[4-[2-(3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolinyl)ethyl]phenyl]-2H-tetrazol-5-yl]-4,5-dimethoxyphenyl]-4-oxo-, hydrochloride (1:1)

Encequidar, HCl

CAS: 849675-88-3

Encequidar (HM-30181) is an oral P-gp inhibitor with potent MDR1 inhibition, enhancing drug bioavailability, and in clinical trials.

Formula: C₃₈H₃₇ClN₆O₇

Color and Shape: Solid

Molecular weight: 725.2

Ref: TM-T68568