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Substance Name: 1,8-Octanedione, 2,7-bis(4-morpholinylmethyl)-1,8-diphenyl-, dihydrochloride
RN: 138371-20-7
InChIKey: HLAHQSXQJHVZTE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H40-N2-O4.2Cl-H

Molecular Weight

  • 565.5778
 
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Names and Synonyms

Synonym

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 138371-20-7

System Generated Number

  • 0138371207

Molecular Formulas

Molecular Formula

  • C30-H40-N2-O4.2Cl-H

Molecular Formula Fragments

  • C30-H40-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C30H40N2O4.2ClH/c33-29(25-9-3-1-4-10-25)27(23-31-15-19-35-20-16-31)13-7-8-14-28(24-32-17-21-36-22-18-32)30(34)26-11-5-2-6-12-26;;/h1-6,9-12,27-28H,7-8,13-24H2;2*1H

InChIKey

HLAHQSXQJHVZTE-UHFFFAOYSA-N

Smiles

c1ccc(cc1)C(=O)C(CCCCC(CN2CCOCC2)C(=O)c3ccccc3)CN4CCOCC4.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LDLo intraperitoneal 200mg/kg (200mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 775, 1991.