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Substance Name: 1,2,4-Triazolo(3,4-a)phthalazine, 3-(3,5-dibromo-2-ethoxyphenyl)-6-(1-pyrrolidinyl)-
RN: 87540-17-8
InChIKey: QQDMAYFIAIIPLW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H19-Br2-N5-O

Molecular Weight

  • 517.2231
 
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Names and Synonyms

Synonyms

  • 3-(3,5-Dibromo-2-ethoxyphenyl)-6-(1-pyrrolidinyl)-1,2,4-triazolo(3,4-a)phthalazine
  • BRN 6448558

Systematic Name

  • 1,2,4-Triazolo(3,4-a)phthalazine, 3-(3,5-dibromo-2-ethoxyphenyl)-6-(1-pyrrolidinyl)-

Registry Numbers

CAS Registry Number

  • 87540-17-8

System Generated Number

  • 0087540178

Structure Descriptors

InChI

1S/C21H19Br2N5O/c1-2-29-18-16(11-13(22)12-17(18)23)20-25-24-19-14-7-3-4-8-15(14)21(26-28(19)20)27-9-5-6-10-27/h3-4,7-8,11-12H,2,5-6,9-10H2,1H3

InChIKey

QQDMAYFIAIIPLW-UHFFFAOYSA-N

Smiles

CCOc1c(cc(cc1Br)Br)c2nnc3n2nc(c4c3cccc4)N5CCCC5

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 600mg/kg (600mg/kg)   Journal of Medicinal Chemistry. Vol. 31, Pg. 1115, 1988.