Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-
RN: 50824-01-6
InChIKey: HBOPAGMMASOZLY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H11-Cl-F2-N4-O

Molecular Weight

  • 300.6949
 
* 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

Synonyms

  • 5-(m-(Chlorodifluoromethoxy)benzyl)-2,4-diamino-pyrimidine
  • 5-25-13-00180 (Beilstein Handbook Reference)
  • BRN 0680641

Systematic Names

  • 2,4-Pyrimidinediamine, 5-((3-(chlorodifluoromethoxy)phenyl)methyl)- (9CI)
  • Pyrimidine, 5-(m-(chlorodifluoromethoxy)benzyl)-2,4-diamino-

Registry Numbers

CAS Registry Number

  • 50824-01-6

System Generated Number

  • 0050824016

Structure Descriptors

InChI

1S/C12H11ClF2N4O/c13-12(14,15)20-9-3-1-2-7(5-9)4-8-6-18-11(17)19-10(8)16/h1-3,5-6H,4H2,(H4,16,17,18,19)

InChIKey

HBOPAGMMASOZLY-UHFFFAOYSA-N

Smiles

c1cc(cc(c1)OC(F)(F)Cl)Cc2cnc(nc2N)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo subcutaneous 160mg/kg (160mg/kg)   Journal of Medicinal Chemistry. Vol. 16, Pg. 1399, 1973.