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Substance Name: 2,4(1H,3H)-Quinazolinedione, 6-chloro-3-(5-(4-phenyl-1-piperazinyl)pentyl)-, dihydrochloride
RN: 13666-69-8
InChIKey: BSOAQGFTHUPACD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H27-Cl-N4-O2.2Cl-H

Molecular Weight

  • 499.867
 
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Names and Synonyms

Synonym

  • 6-Chloro-3-(5-(4-phenyl-1-piperazinyl)pentyl)-2,4(1H,3H)-quinazolinedione dihydrochloride

Systematic Name

  • 2,4(1H,3H)-Quinazolinedione, 6-chloro-3-(5-(4-phenyl-1-piperazinyl)pentyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 13666-69-8

System Generated Number

  • 0013666698

Molecular Formulas

Molecular Formula

  • C23-H27-Cl-N4-O2.2Cl-H

Molecular Formula Fragments

  • C23-H27-Cl-N4-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H27ClN4O2.2ClH/c24-18-9-10-21-20(17-18)22(29)28(23(30)25-21)12-6-2-5-11-26-13-15-27(16-14-26)19-7-3-1-4-8-19;;/h1,3-4,7-10,17H,2,5-6,11-16H2,(H,25,30);2*1H

InChIKey

BSOAQGFTHUPACD-UHFFFAOYSA-N

Smiles

[nH]1c2ccc(cc2c(n(CCCCCN2CCN(CC2)c2ccccc2)c1=O)=O)Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1470mg/kg (1470mg/kg)   United States Patent Document. Vol. #3919425,