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Substance Name: Epanolol [USAN:INN:BAN]
RN: 86880-51-5
UNII: 9KGC55KP6A
InChIKey: YARKMNAWFIMDKV-UHFFFAOYSA-N

Molecular Formula

  • C20-H23-N3-O4

Molecular Weight

  • 369.419
 

Classification Codes

  • Adrenergic Agents
  • Adrenergic Antagonists
  • Adrenergic beta-Antagonists
  • Antihypertensive Agents
  • Autonomic Agents
  • Cardiovascular Agents
  • Neurotransmitter Agents
  • Peripheral Nervous System Agents
  • Sympathomimetics
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Names and Synonyms

Name of Substance

  • Epanolol
  • Epanolol [USAN:INN:BAN]

Synonyms

  • (+-)-N-(2-((3-(o-Cyanophenoxy)-2-hydroxypropyl)amino)ethyl)-2-(p-hydroxyphenyl)acetamide
  • Epanolol
  • Epanololum
  • Epanololum [Latin]
  • ICI 141,292
  • UNII-9KGC55KP6A

Systematic Names

  • (+-)-N-(2-((3-(o-Cyanophenoxy)-2-hydroxypropyl)amino)ethyl)-2-(p-hydroxyphenyl)acetamide
  • Benzeneacetamide, N-(2-((3-(2-cyanophenoxy)-2-hydroxypropyl)amino)ethyl)-4-hydroxy-

Registry Numbers

CAS Registry Number

  • 86880-51-5

FDA UNII

  • 9KGC55KP6A

System Generated Number

  • 0086880515

Structure Descriptors

InChI

1S/C20H23N3O4/c21-12-16-3-1-2-4-19(16)27-14-18(25)13-22-9-10-23-20(26)11-15-5-7-17(24)8-6-15/h1-8,18,22,24-25H,9-11,13-14H2,(H,23,26)

InChIKey

YARKMNAWFIMDKV-UHFFFAOYSA-N

Smiles

c1(ccc(cc1)O)CC(NCCNC[C@@H](COc1ccccc1C#N)O)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 118-120 deg C   EXP
log P (octanol-water) 0.92 (none)   EXP
Water Solubility 1600 mg/L 25 EST
Vapor Pressure 5.60E-16 mm Hg 25 EST
Henry's Law Constant 1.67E-25 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.57E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.