1-(6-Chloro-5-fluoro-1-indolyl)-2-propanamine

Base Information

• Chemical Name: 1-(6-Chloro-5-fluoro-1-indolyl)-2-propanamine
• CAS No.: 169675-09-6
• Molecular Formula: C15H16ClFN2O4
• Molecular Weight: 342.75
• European Community (EC) Number: 663-193-6
• Wikidata: Q27163547
• Mol file: 169675-09-6.mol

Synonyms:1-(6-chloro-5-fluoro-1-indolyl)-2-propanamine;Ro 60-0175;1-(6-chloro-5-fluoroindol-1-yl)propan-2-amine;SCHEMBL8959606;BDBM85528;CHEBI:91736;ICX5608849;CAS_3045226;NSC_3045226;1-(6-chloro-5-fluoroindol-1-yl)-propan-2-amine;L000517;1-(6-chloro-5-fluoro-1H-indol-1-yl)propan-2-amine;2-(6-chloro-5-fluoroindol-1-yl)-1-methylethylamine;BRD-A49370193-051-01-7;Q27163547

Chemical Property of 1-(6-Chloro-5-fluoro-1-indolyl)-2-propanamine

Chemical Property:

• Vapor Pressure: 3.65E-05mmHg at 25°C
• Boiling Point: 353.2°Cat760mmHg
• Flash Point: 167.4°C
• PSA: 105.55000
• Density: g/cm³
• LogP: 3.19310
• Storage Temp.: Desiccate at RT
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 226.0673042
• Heavy Atom Count: 15
• Complexity: 227

Purity/Quality:

98%min ^*data from raw suppliers

Ro 60-0175 fumarate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(CN1C=CC2=CC(=C(C=C21)Cl)F)N
• Description: Ro 60-0175 is an agonist of the serotonin (5-HT) receptor subtype 5-HT2 that stimulates increases in intracellular calcium levels in CHO-K1 cells expressing human 5-HT2A, 5-HT2B, and 5-HT2C receptors (EC50s = 447, 0.9, and 32 nM, respectively). It is selective for human 5-HT2A and 5-HT2C (Kis = 32 and 1 nM, respectively) over human 5-HT1A, 5-HT1D, 5-HT6, and 5-HT7, rat 5-HT1B and 5-HT3, and guinea pig 5-HT4 receptors (Kis = ≥1,995 nM), as well as adenosine A1 and A2, histamine H1-3, dopamine D1-5, α1-, α2-, and β1-adrenergic, M1-5 muscarinic, nicotinic, kainate, AMPA, and μ-, δ-, and κ-opioid receptors (IC50s = >1,000 nM), but does bind to β2-adrenergic receptors (IC50 = 251 nM). In vivo, Ro 60-0175 increases plasma levels of corticosterone, oxytocin, and prolactin in rats (ED50s = 2.43, 4.19, and 4.03 mg/kg, respectively), effects that are not inhibited by the 5-HT2C antagonist SB-242084 or the 5-HT2A antagonist MDL 100,907 (volinanserin; ).
• Uses: Ro 60-0175 fumarate is a potent and selective SR-2 agonist.