Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-(3-((phenyl-3-pyridinylmethyl)amino)propyl)-,dihydrochloride, (+-)-
RN: 110622-77-0
InChIKey: AITXVMMALUPJDA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H24-N6-O2.2Cl-H

Molecular Weight

  • 477.3934
 
* 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

  • RTECS UR6846000

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-(3-((phenyl-3-pyridinylmethyl)amino)propyl)-,dihydrochloride, (+-)-

Registry Numbers

CAS Registry Number

  • 110622-77-0

System Generated Number

  • 0110622770

Molecular Formulas

Molecular Formula

  • C22-H24-N6-O2.2Cl-H

Molecular Formula Fragments

  • C22-H24-N6-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H24N6O2.2ClH/c1-26-20-19(21(29)27(2)22(26)30)28(15-25-20)13-7-12-24-18(16-8-4-3-5-9-16)17-10-6-11-23-14-17;;/h3-6,8-11,14-15,18,24H,7,12-13H2,1-2H3;2*1H

InChIKey

AITXVMMALUPJDA-UHFFFAOYSA-N

Smiles

Cn1c2c(c(=O)n(c1=O)C)n(cn2)CCCNC(c3ccccc3)c4cccnc4.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 300mg/kg (300mg/kg)   Farmaco, Edizione Scientifica. Vol. 42, Pg. 561, 1987.