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Substance Name: 1-Acridinol, 1,2,3,4-tetrahydro-9-(((2-fluorophenyl)methyl)amino)-, (Z)-2-butenedioate (1:1)
RN: 104675-48-1
InChIKey: PGXNOLCSZBVLKV-BTJKTKAUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H19-F-N2-O.C4-H4-O4

Molecular Weight

  • 438.4527
 
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Names and Synonyms

Synonym

  • 1,2,3,4-Tetrahydro-9-(((2-fluorophenyl)methyl)amino)-1-acridinol maleate

Systematic Name

  • 1-Acridinol, 1,2,3,4-tetrahydro-9-(((2-fluorophenyl)methyl)amino)-, (Z)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 104675-48-1

System Generated Number

  • 0104675481

Molecular Formulas

Molecular Formula

  • C24-H19-F-N2-O.C4-H4-O4

Molecular Formula Fragments

  • C24-H19-F-N2-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C20H19FN2O.C4H4O4/c21-15-8-3-1-6-13(15)12-22-20-14-7-2-4-9-16(14)23-17-10-5-11-18(24)19(17)20;5-3(6)1-2-4(7)8/h1-4,6-9,18,24H,5,10-12H2,(H,22,23);1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

PGXNOLCSZBVLKV-BTJKTKAUSA-N

Smiles

c1ccc(c(c1)CNc2c3ccccc3nc4c2C(CCC4)O)F.C(=C\C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal > 40mg/kg (40mg/kg)   Journal of Medicinal Chemistry. Vol. 32, Pg. 1805, 1989.