Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1,8-Octanedione, 2,7-bis(4-morpholinylmethyl)-1,8-bis(4-propoxyphenyl)-, dihydrochloride
RN: 138371-23-0
InChIKey: ZRUAXZJJLMPJDW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C36-H52-N2-O6.2Cl-H

Molecular Weight

  • 681.7366
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • 2,7-Bis(4-morpholinylmethyl)-1,8-bis(4-propoxyphenyl)-1,8-octanedione dihydrochloride

Systematic Name

  • 1,8-Octanedione, 2,7-bis(4-morpholinylmethyl)-1,8-bis(4-propoxyphenyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 138371-23-0

System Generated Number

  • 0138371230

Molecular Formulas

Molecular Formula

  • C36-H52-N2-O6.2Cl-H

Molecular Formula Fragments

  • C36-H52-N2-O6
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C36H52N2O6.2ClH/c1-3-21-43-33-13-9-29(10-14-33)35(39)31(27-37-17-23-41-24-18-37)7-5-6-8-32(28-38-19-25-42-26-20-38)36(40)30-11-15-34(16-12-30)44-22-4-2;;/h9-16,31-32H,3-8,17-28H2,1-2H3;2*1H

InChIKey

ZRUAXZJJLMPJDW-UHFFFAOYSA-N

Smiles

CCCOc1ccc(cc1)C(=O)C(CCCCC(CN2CCOCC2)C(=O)c3ccc(cc3)OCCC)CN4CCOCC4.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LDLo intraperitoneal 100mg/kg (100mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 775, 1991.