ChemicalBook--->CAS DataBase List--->77671-31-9

77671-31-9

77671-31-9 Structure

77671-31-9 Structure
IdentificationMore
[Name]

Enoximone
[CAS]

77671-31-9
[Synonyms]

1,3-DIHYDRO-4-METHYL-5-[4-METHYLTHIOBENZOYL]-2H-IMIDAZOL-2-ONE
ENOXIMONE
2H-Imidazol-2-one, 1,3-dihydro-4-methyl-5-(4-(methylthio)benzoyl)-
Fenoximone
MDL-17043
Pedane
Perfan
RMI-17043
[Molecular Formula]

C12H12N2O2S
[MDL Number]

MFCD00867130
[Molecular Weight]

248.3
[MOL File]

77671-31-9.mol
Chemical PropertiesBack Directory
[Melting point ]

255-258°C
[density ]

1.33
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

DMSO: 28 mg/mL, soluble
[form ]

solid
[pka]

10.37±0.70(Predicted)
[color ]

light yellow
[InChI]

1S/C12H12N2O2S/c1-7-10(14-12(16)13-7)11(15)8-3-5-9(17-2)6-4-8/h3-6H,1-2H3,(H2,13,14,16)
[InChIKey]

ZJKNESGOIKRXQY-UHFFFAOYSA-N
[SMILES]

CSc1ccc(cc1)C(=O)C2=C(C)NC(=O)N2
[CAS DataBase Reference]

77671-31-9(CAS DataBase Reference)
Safety DataBack Directory
[RIDADR ]

3249
[WGK Germany ]

3
[HazardClass ]

6.1(b)
[PackingGroup ]

III
[Storage Class]

10 - Combustible liquids
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethyl acetate-->Nitrous acid
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Enoximone(77671-31-9).msds
Hazard InformationBack Directory
[Description]

Enoximone is a phosphodiesterase inhibitor indicated for selective use as a cardiostimulant in heart transplant patient maintenance. It is currently being investigated for other indications including acute congestive heart failure.
[Chemical Properties]

Crystallized from isopropyl alcohol-water, melting point 255-258°C (decomposition).
[Originator]

Merrell Dow (USA)
[Uses]

Enoximone is a phosphodiesterase inhibitor used in the treatment of congestive heart failure and is selective to phosphodiesterase 3. Potent PDE-3 inhibitor.
[Definition]

ChEBI: Enoximone is an aromatic ketone.
[Brand name]

Perfan IV
[Biological Activity]

Inhibitor of type III phosphodiesterase (PDE3). Increases intracellular cyclic AMP (cAMP) concentrations and enhances myocardial contractility. Also induces concentration-dependent vasodilation in vitro .
[Biochem/physiol Actions]

Selective phosphodiesterase III (PDE3) inhibitor. Prevents the degradation of cAMP by PDE. Increased cAMP results in enhanced contractility of the heart.
[storage]

Store at -20°C
Spectrum DetailBack Directory
[Spectrum Detail]

Enoximone(77671-31-9)1HNMR
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