Isomazole Hydrochloride
Basic information
- CAS
87359-33-9- Standard SMILES
COc1cc(S(C)=O)ccc1-c1nc2ccncc2[nH]1.Cl- InChIKey
OJDNVOWLGHYRPR-UHFFFAOYSA-N- Molecular formula
- C14H14ClN3O2S
- Average molar mass
- 323.8 g/mol
- Monoisotopic mass
- 323.0495256
Overview
See also: Isomazole (has active moiety).
Names & identifiers
- Preferred name
- Isomazole Hydrochloride
- IUPAC
- 2-(2-methoxy-4-methylsulfinylphenyl)-3H-imidazo[4,5-c]pyridine;hydrochloride
- English name
- Isomazolehydrochloride
- Molecular weight
- 0
Names & synonyms
ISOMAZOLE HYDROCHLORIDEIsomazole HCl87359-33-9LY 175326LY-175326QA075T23R11H-Imidazo(4,5-c)pyridine, 2-(2-methoxy-4-(methylsulfinyl)phenyl)-, monohydrochlorideRefChem:149536LY175326Isomazole hydrochloride [USAN]Isomazole (hydrochloride)2-(2-Methoxy-4-(methylsulfinyl)phenyl)-1H-imidazo(4,5-c)pyridine monohydrochloride
Show more names
Isomazolehydrochloride
Isomazole hydrochloride (USAN)2-(2-methoxy-4-methylsulfinylphenyl)-3H-imidazo[4,5-c]pyridine;hydrochlorideUNII-QA075T23R12-[2-Methoxy-4-(methylsulfinyl)phenyl]-1H-imidazo[4,5-c]pyridine monohydrochloride87359-33-9 (HCl)2-(2-Methoxy-4-(methylsulfinyl)phenyl)-1H-imidazo(4,5-c)pyridine hydrochlorideSCHEMBL121627BW-A746C
Database identifiers
- CAS
87359-33-9- PubChem CID
- 55689
- DTXSID
DTXSID801007502- ChEMBL
CHEMBL2105021- UNII
- QA075T23R1
Properties
Computed structural properties
- Topological polar surface area
- 87.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 368
Physicochemical properties
- FDA UNII
- 75 T23R1 · QA075T23R1
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Agents that have a strengthening effect on the heart or that can increase cardiac output. They may be CARDIAC GLYCOSIDES; SYMPATHOMIMETICS; or other drugs. They are used after MYOCARDIAL INFARCT; CARDIAC SURGICAL PROCEDURES; in SHOCK; or in congestive heart failure (HEART FAILURE).
Compounds which inhibit or antagonize the biosynthesis or actions of phosphodiesterases.
Applications
UsesCardiotonic.
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Related reactions
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Compound notes
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