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Substance Name: Theofibrate [USAN]
RN: 54504-70-0
UNII: 14UH1JQP6L
InChIKey: KYAKGJDISSNVPZ-UHFFFAOYSA-N

Note

  • Whole issue.

Molecular Formula

  • C19-H21-Cl-N4-O5

Molecular Weight

  • 420.8509
 

Classification Codes

  • Antihyperlipoproteinemic
  • Antimetabolites
  • Antioxidants
  • Drug / Therapeutic Agent
  • Hypolipidemic Agents
  • Lipid Regulating Agents
  • Protective Agents
  • Radiation-Sensitizing Agents
  • Reproductive Effect
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Names and Synonyms

Name of Substance

  • Etofylline clofibrate
  • Etofylline clofibrate [INN]
  • Theofibrate [USAN]

Synonyms

  • 1-(7-Theophyllinyl)-2-ethyl (2-(p-chlorophenoxy)isobutyrate)
  • 1-(Theophyllin-7-yl)-aethyl-2 2-(p-chlorphenoxy)-2-methylpropionat
  • 1-(Theophyllin-7-yl)-aethyl-2 2-(p-chlorphenoxy)-2-methylpropionat [German]
  • 1-(Theophyllin-7-yl)-ethyl-2 2-(p-chlorophenoxy)-2-methylpropionate
  • 1-(Theophyllin-7-yl)-ethyl-2-(2-(p-chlorophenoxy)-2-methylpropionate)
  • 2-(p-Chlorophenoxy)-2-methylpropionic acid, ester with 7-(2-hydroxyethyl)theophylline
  • BRN 1233286
  • Clofibrate d'etofylline
  • Clofibrate d'etofylline [INN-French]
  • Clofibrato de etofilina
  • Clofibrato de etofilina [INN-Spanish]
  • Duolip
  • EINECS 259-191-6
  • Etofyllinclofibrat
  • Etofyllinclofibrat [German]
  • Etofyllinclofibrate
  • Etofylline clofibrate
  • Etofyllini clofibras
  • Etofyllini clofibras [INN-Latin]
  • ML 1024
  • ML-1024
  • NSC 234348
  • Propanoic acid, 2-(4-chlorophenoxy)-2-methyl-, 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl ester
  • Theofibrate
  • UNII-14UH1JQP6L

Systematic Names

  • Etofylline clofibrate
  • Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl) ethyl ester

Registry Numbers

CAS Registry Number

  • 54504-70-0

FDA UNII

  • 14UH1JQP6L

System Generated Number

  • 0054504700

Structure Descriptors

InChI

1S/C19H21ClN4O5/c1-19(2,29-13-7-5-12(20)6-8-13)17(26)28-10-9-24-11-21-15-14(24)16(25)23(4)18(27)22(15)3/h5-8,11H,9-10H2,1-4H3

InChIKey

KYAKGJDISSNVPZ-UHFFFAOYSA-N

Smiles

CC(C)(C(=O)OCCn1cnc2c1c(=O)n(c(=O)n2C)C)Oc3ccc(cc3)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 oral > 10gm/kg (10000mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 27, Pg. 1173, 1977.
rat LD50 intraperitoneal 2830mg/kg (2830mg/kg) LIVER: OTHER CHANGES Arzneimittel-Forschung. Drug Research. Vol. 30, Pg. 2023, 1980.
rat LD50 oral 17000mg/kg (17000mg/kg) LIVER: OTHER CHANGES Arzneimittel-Forschung. Drug Research. Vol. 30, Pg. 2023, 1980.