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Substance Name: 4,7-Phenanthroline, 1,2,3,4,4a,5,6,10b-octahydro-4-propyl-, maleate, trans-
RN: 101225-47-2
InChIKey: QTQUXQDWAPAYFQ-AKIJKIDDSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H22-N2.C4-H4-O4

Molecular Weight

  • 346.4244
 
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Names and Synonyms

Synonym

  • trans-4-Propyl-1,2,3,4,4a,5,6,10b-octahydro-4,7-phenanthroline maleate

Systematic Name

  • 4,7-Phenanthroline, 1,2,3,4,4a,5,6,10b-octahydro-4-propyl-, maleate, trans-

Registry Numbers

CAS Registry Number

  • 101225-47-2

System Generated Number

  • 0101225472

Molecular Formulas

Molecular Formula

  • C15-H22-N2.C4-H4-O4

Molecular Formula Fragments

  • C15-H22-N2
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C15H22N2.C4H4O4/c1-2-10-17-11-4-6-13-12-5-3-9-16-14(12)7-8-15(13)17;5-3(6)1-2-4(7)8/h3,5,9,13,15H,2,4,6-8,10-11H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t13-,15-;/m1./s1

InChIKey

QTQUXQDWAPAYFQ-AKIJKIDDSA-N

Smiles

CCCN1CCC[C@H]2[C@H]1CCc3c2cccn3.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 183mg/kg (183mg/kg) BEHAVIORAL: REGIDITY

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Medicinal Chemistry. Vol. 29, Pg. 1061, 1986.