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Substance Name: Antazoline 7-theophyllineacetate
RN: 38953-17-2
InChIKey: ZGFXUMXDHMGPPO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H19-N3.C9-H10-N4-O4

Molecular Weight

  • 741.7621
 
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Names and Synonyms

Results Name

  • Antazoline 7-theophyllineacetate

Synonyms

  • Antazoline 7-theophyllineacetate
  • Theophylline 7 acetate d'antazoline
  • Theophylline 7 acetate d'antazoline [French]

Systematic Name

  • 7H-Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-, compd. with 4,5-dihydro-N-phenyl-N-(phenylmethyl)-1H-imidazole-2-methanamine (1:1)

Registry Numbers

CAS Registry Number

  • 38953-17-2

System Generated Number

  • 0038953172

Molecular Formulas

Molecular Formula

  • C17-H19-N3.C9-H10-N4-O4

Molecular Formula Fragments

  • C17-H19-N3
  • C9-H10-N4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C17H19N3.2C9H10N4O4/c1-3-7-15(8-4-1)13-20(14-17-18-11-12-19-17)16-9-5-2-6-10-16;2*1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15/h1-10H,11-14H2,(H,18,19);2*4H,3H2,1-2H3,(H,14,15)

InChIKey

ZGFXUMXDHMGPPO-UHFFFAOYSA-N

Smiles

Cn1c2c(c(=O)n(c1=O)C)n(cn2)CC(=O)O.Cn1c2c(c(=O)n(c1=O)C)n(cn2)CC(=O)O.c1ccc(cc1)CN(CC2=NCCN2)c3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 75mg/kg (75mg/kg)   French Demande Patent Document. Vol. #2096978,
mouse LD50 oral 580mg/kg (580mg/kg)   French Demande Patent Document. Vol. #2096978,