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Substance Name: 1,3-Propanediamine, N,N-bis(2-chloroethyl)-N'-(7-chloro-2-methoxybenzo(b)-1,5-naphthyridin-10-yl)-, dihydrochloride
RN: 38915-35-4
InChIKey: PPSJQJIJRYYVKQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H23-Cl3-N4-O.2Cl-H

Molecular Weight

  • 514.7095
 
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Names and Synonyms

Synonym

  • ICR 349

Systematic Name

  • 1,3-Propanediamine, N,N-bis(2-chloroethyl)-N'-(7-chloro-2-methoxybenzo(b)-1,5-naphthyridin-10-yl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 38915-35-4

System Generated Number

  • 0038915354

Molecular Formulas

Molecular Formula

  • C20-H23-Cl3-N4-O.2Cl-H

Molecular Formula Fragments

  • C20-H23-Cl3-N4-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H23Cl3N4O.2ClH/c1-28-18-6-5-16-20(26-18)19(15-4-3-14(23)13-17(15)25-16)24-9-2-10-27(11-7-21)12-8-22;;/h3-6,13H,2,7-12H2,1H3,(H,24,25);2*1H

InChIKey

PPSJQJIJRYYVKQ-UHFFFAOYSA-N

Smiles

COc1ccc2c(n1)c(c3ccc(cc3n2)Cl)NCCCN(CCCl)CCCl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD20 intraperitoneal 1mg/kg (1mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 739, 1972.