ChemicalBook--->CAS DataBase List--->82768-85-2

82768-85-2

82768-85-2 Structure

82768-85-2 Structure
IdentificationBack Directory
[Name]

QUINAPRILAT HYDRATE
[CAS]

82768-85-2
[Synonyms]

ci928
CI-92
quinaprilat
Quinapril USP RC B
QUINAPRILAT HYDRATE
Quinapril EP Impurity C
Quinapril Related CoMpound B
Quinapril USP Related CoMpound B
(3s-(2(r*(r*)),3r*))-yl)amino)-1-oxopropyl)
3-isoquinolinecarboxylicacid,1,2,3,4-tetrahydro-2-(2-((1-carboxy-3-phenylprop
(3S)-2-[(S)-2-[[(S)-1-Carboxy-3-phenylpropyl]amino]propionyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
3-Isoquinolinecarboxylic acid, 2-(2S)-2-(1S)-1-carboxy-3-phenylpropylamino-1-oxopropyl-1,2,3,4-tetrahydro-, (3S)-
(3S)-2-[(S)-2-[[(S)-1-Carboxy-3-phenylpropyl]amino]-1-oxopropyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
(3S)-2-[(2S)-2-[[(1S)-1-Carboxy-3-phenylpropyl]amino]-1-oxopropyl]-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic Acid
(3S)-2-[(2S)-2-[[(1S)-1-Carboxy-3-phenylpropyl]amino]-1-oxopropyl]-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid hydrate
Quinapril Related Compound B (50 mg) (3-Isoquinolinecarboxylic acid, 2-[2-[(1-carboxy-3-phenylpropyl)amino]-1-oxopropyl]-1,2,3,4-tetrahydro-,[3S-[2[R*(R*)],3R*]]-)
[Molecular Formula]

C23H26N2O5
[MDL Number]

MFCD08060097
[MOL File]

82768-85-2.mol
[Molecular Weight]

410.47
Chemical PropertiesBack Directory
[Appearance]

Crystalline Solid
[Melting point ]

166-1680C
[alpha ]

D23 +20.9° (c = 1 in methanol)
[Boiling point ]

674.5±55.0 °C(Predicted)
[density ]

1.289±0.06 g/cm3(Predicted)
[storage temp. ]

Refrigerator
[solubility ]

DMSO: ≥23mg/mL
[form ]

powder
[pka]

2.19±0.10(Predicted)
[color ]

white to tan
[Optical Rotation]

[α]/D +16 to +23 (C=1, MeOH)
[CAS DataBase Reference]

82768-85-2
Hazard InformationBack Directory
[Chemical Properties]

Crystalline Solid
[Uses]

A metabolite of Quinapril, an angiotensin converting enzyme (ACE) inhibitor.
[Definition]

ChEBI:Quinaprilat is a dicarboxylic acid resulting from the hydrolysis of the ethyl ester group of quinapril to give the corresponding dicarboxylic acid. The active angiotensin-converting enzyme inhibitor (ACE inhibitor) of the prodrug quinapril. It has a role as an EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor, an antihypertensive agent and a vasodilator agent. It is a dicarboxylic acid, a member of isoquinolines and a tertiary carboxamide.
[storage]

-20°C
Safety DataBack Directory
[Hazard Codes ]

T,N
[Risk Statements ]

25-50
[Safety Statements ]

45-61
[RIDADR ]

UN 2811 6.1 / PGIII
[WGK Germany ]

3
[HS Code ]

2933492250
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