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Substance Name: Doxofylline [USAN:INN]
RN: 69975-86-6
UNII: MPM23GMO7Z
InChIKey: HWXIGFIVGWUZAO-UHFFFAOYSA-N

Molecular Formula

  • C11-H14-N4-O4

Molecular Weight

  • 266.256
 

Classification Codes

  • Anti-Asthmatic Agents
  • Antitussive Agents
  • Autonomic Agents
  • Bronchodilator
  • Bronchodilator Agents
  • Central Nervous System Agents
  • Drug / Therapeutic Agent
  • Enzyme Inhibitors
  • Peripheral Nervous System Agents
  • Phosphodiesterase Inhibitors
  • Respiratory System Agents
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Names and Synonyms

Name of Substance

  • Doxofylline
  • Doxofylline [USAN:INN]

Synonyms

  • 2-(7'-Teofillinmetil)-1,3-diossolano
  • 2-(7'-Teofillinmetil)-1,3-diossolano [Italian]
  • 2-(7'-Theophyllinemethyl)-1,3-dioxolane
  • 5-26-14-00120 (Beilstein Handbook Reference)
  • 7-(1,3-Dioxolan-2-ylmethyl)theophylline
  • 7-(1,3-Dioxolon-2-ylmethyl)-1,2,3,6-tetrahydro-1,3-dimethyl-2,6-purindion
  • ABC 12/3
  • Ansimar
  • BRN 0561195
  • Dioxyfilline
  • Doxofilina
  • Doxofilina [INN-Spanish]
  • Doxofylline
  • Doxofyllinum
  • Doxofyllinum [INN-Latin]
  • Doxophylline
  • EINECS 274-239-6
  • Maxivent
  • UNII-MPM23GMO7Z
  • Ventax

Systematic Names

  • 1H-Purine-2,6-dione, 3,7-dihydro-7-(1,3-dioxolan-2-ylmethyl)-1,3-dimethyl- (9CI)
  • 1H-Purine-2,6-dione, 7-(1,3-dioxolan-2-ylmethyl)-3,7-dihydro-1,3-dimethyl-
  • Doxofylline
  • Theophylline, 7-(1,3-dioxolan-2-ylmethyl)-

Registry Numbers

CAS Registry Number

  • 69975-86-6

FDA UNII

  • MPM23GMO7Z

System Generated Number

  • 0069975866

Structure Descriptors

InChI

1S/C11H14N4O4/c1-13-9-8(10(16)14(2)11(13)17)15(6-12-9)5-7-18-3-4-19-7/h6-7H,3-5H2,1-2H3

InChIKey

HWXIGFIVGWUZAO-UHFFFAOYSA-N

Smiles

c12c(n(c(=O)n(c2=O)C)C)ncn1CC1OCCO1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 396mg/kg (396mg/kg)   United States Patent Document. Vol. #4187308,
mouse LD50 intravenous 216mg/kg (216mg/kg)   Farmaco, Edizione Scientifica. Vol. 36, Pg. 201, 1981.
mouse LD50 oral 841mg/kg (841mg/kg)   Farmaco, Edizione Scientifica. Vol. 36, Pg. 201, 1981.
rat LD50 intraperitoneal 426mg/kg (426mg/kg)   United States Patent Document. Vol. #4187308,
rat LD50 intravenous 315mg/kg (315mg/kg)   United States Patent Document. Vol. #4187308,
rat LD50 oral 965mg/kg (965mg/kg)   United States Patent Document. Vol. #4868186,