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Substance Name: Benzenemethanol, 4-((2,4-diamino-5-pyrimidinyl)methyl)-alpha,alpha-diethyl-2,6-dimethoxy-
RN: 55687-96-2
InChIKey: PHWSMYKJHWXOBG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H26-N4-O3

Molecular Weight

  • 346.4284
 
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Names and Synonyms

Synonyms

  • 4-((2,4-Diamino-5-pyrimidinyl)methyl)-alpha,alpha-diethyl-2,6-dimethoxybenzenemethanol
  • 5-25-13-00440 (Beilstein Handbook Reference)
  • BRN 0713072

Systematic Name

  • Benzenemethanol, 4-((2,4-diamino-5-pyrimidinyl)methyl)-alpha,alpha-diethyl-2,6-dimethoxy-

Registry Numbers

CAS Registry Number

  • 55687-96-2

System Generated Number

  • 0055687962

Structure Descriptors

InChI

1S/C18H26N4O3/c1-5-18(23,6-2)15-13(24-3)8-11(9-14(15)25-4)7-12-10-21-17(20)22-16(12)19/h8-10,23H,5-7H2,1-4H3,(H4,19,20,21,22)

InChIKey

PHWSMYKJHWXOBG-UHFFFAOYSA-N

Smiles

CCC(CC)(c1c(cc(cc1OC)Cc2cnc(nc2N)N)OC)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 5gm/kg (5000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 15, Pg. 17, 1980.