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Substance Name: Carocainide [INN]
RN: 66203-00-7
UNII: T643E80J9K
InChIKey: BWMMRMDCODVQBX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H25-N3-O5

Molecular Weight

  • 363.411
 
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Names and Synonyms

Name of Substance

  • Carocainide
  • Carocainide [INN]

Synonyms

  • 1-(4,7-Dimethoxy-6-(2-(1-pyrrolidinyl)ethoxy)-5-benzofuranyl)-3-methylurea
  • BRN 5154193
  • Carocainida
  • Carocainida [INN-Spanish]
  • Carocainide
  • Carocainidum
  • Carocainidum [INN-Latin]
  • EINECS 266-233-7
  • N-(4,7-Dimethoxy-6-(2-pyrrolidinoethoxy)-5-benzofuranyl)-N'-methylurea
  • UNII-T643E80J9K

Systematic Names

  • 1-(4,7-Dimethoxy-6-(2-(1-pyrrolidinyl)ethoxy)-5-benzofuranyl)-3-methylurea
  • Carocainide
  • Urea, 1-(4,7-dimethoxy-6-(2-(1-pyrrolidinyl)ethoxy)-5-benzofuranyl)-3-methyl-

Registry Numbers

CAS Registry Number

  • 66203-00-7

FDA UNII

  • T643E80J9K

System Generated Number

  • 0066203007

Structure Descriptors

InChI

1S/C18H25N3O5/c1-19-18(22)20-13-14(23-2)12-6-10-25-15(12)17(24-3)16(13)26-11-9-21-7-4-5-8-21/h6,10H,4-5,7-9,11H2,1-3H3,(H2,19,20,22)

InChIKey

BWMMRMDCODVQBX-UHFFFAOYSA-N

Smiles

C1CCN(C1)CCOc1c(OC)c2occc2c(c1NC(NC)=O)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 88mg/kg (88mg/kg) CARDIAC: OTHER CHANGES Journal of Medicinal Chemistry. Vol. 24, Pg. 159, 1981.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.38 (none)   EXP
Water Solubility 341 mg/L 25 EST
Vapor Pressure 1.73E-10 mm Hg 25 EST
Henry's Law Constant 4.56E-18 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.22E-10 cm3/molecule-sec 25 EST

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