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Substance Name: Benzo(b)(1,10)phenanthroline, 7-(3-(N-(2-chloroethyl)-N-propylamino)propylamino)-, trihydrochloride
RN: 38915-59-2
InChIKey: PGSWPAFPWLYZJI-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Tumor Data

Molecular Formula

  • C24-H27-Cl-N4.3Cl-H

Molecular Weight

  • 516.341
 
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Names and Synonyms

Synonyms

  • 7-(3-(2-Chloroethyl-n-propylamino)propylamino)benzo(b)(1,10)-phenathroline hydrochloride
  • ICR 394

Systematic Name

  • Benzo(b)(1,10)phenanthroline, 7-(3-(N-(2-chloroethyl)-N-propylamino)propylamino)-, trihydrochloride

Registry Numbers

CAS Registry Number

  • 38915-59-2

System Generated Number

  • 0038915592

Molecular Formulas

Molecular Formula

  • C24-H27-Cl-N4.3Cl-H

Molecular Formula Fragments

  • C24-H27-Cl-N4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C24H27ClN4.3ClH/c1-2-15-29(17-12-25)16-6-14-27-23-19-8-3-4-9-21(19)28-24-20(23)11-10-18-7-5-13-26-22(18)24;;;/h3-5,7-11,13H,2,6,12,14-17H2,1H3,(H,27,28);3*1H

InChIKey

PGSWPAFPWLYZJI-UHFFFAOYSA-N

Smiles

c12c(c3c(ccc[n+]3)cc2)[n+]c2ccccc2c1NCCC[N@@H+](CCC)CCCl.[ClH-].[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD20 intraperitoneal 1136ug/kg (1.136mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 739, 1972.