Flutonidine
Basic information
- CAS
28125-87-3- Standard SMILES
Cc1ccc(F)cc1NC1=NCCN1- InChIKey
UYIZEUBMWCOJFF-UHFFFAOYSA-N- Molecular formula
- C10H12FN3
- Average molar mass
- 193.22 g/mol
- Monoisotopic mass
- 193.10152556
Overview
Flutonidine is a small molecule drug. The usage of the INN stem '-nidine' in the name indicates that Flutonidine is a a2 adrenoreceptor agonist. Flutonidine has a monoisotopic molecular weight of 193.1 Da.
Names & identifiers
- Preferred name
- Flutonidine
- IUPAC
- N-(5-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine
- English name
- Flutonidine
- Molecular formula
- C10H12FN3
- Molecular weight
- 193.22
Names & synonyms
Flutonidine28125-87-3FlutonidinaFlutonidinumST 600ZCC19F3X8KST-600DTXSID901824055-Fluoro-2-methylimidazolidinylidenebenzamineflutonidin2-(5-fluoro-o-toluidine)-2-imidazolineRefChem:141075
Show more names
N-(5-fluoro-2-Methylphenyl)-2-iMidazolidineiMine1H-Imidazol-2-amine, N-(5-fluoro-2-methylphenyl)-4,5-dihydro-
DTXCID60104896Flutonidine [INN]N-(5-fluoro-2-methylphenyl)-4,5-dihydro-1H-imidazol-2-amine2-(5-Fluoro-o-toluidino)-2-imidazolineFlutonidina [INN-Spanish]Flutonidinum [INN-Latin]UNII-ZCC19F3X8KSCHEMBL352837
Database identifiers
- CAS
28125-87-3- PubChem CID
- 65761
- DTXSID
DTXSID90182405- ChEMBL
CHEMBL2106760- UNII
- ZCC19F3X8K
- Nikkaji
- J21.609G
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 36.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 229
Physicochemical properties
- Boiling point
- 273.7 · 273.7±50.0 °C(Predicted)
- Density
- 1.26 · 1.26±0.1 g/cm3(Predicted)
- pka
- 9 · 9+-.0.50(Predicted)
- FDA UNII
- 19 F3X8K · ZCC19F3X8K
- Comptox DTXSID
- 90182405 · DTXSID90182405
Chemistry & industry
Applications
UsesFlutonidine (ST-600) is a Clonidine (HY-12721) analogue that shows antihypertensive and sympatholytic effects. The initial hypertension produced by Flutonidine is due to stimulation of the peripheral α1, α2 adrenoceptors and the subsequent fall in blood pressure is due to the stimulation of central α2 adrenoceptors. Flutonidine reduces the arrhythmogenic and lethal effects of ouabain. Flutonidine is promising for research of ventricular arrhythmias caused by cardiac glycosides[1][2].
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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