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Substance Name: 1,2,4-Triazolo(3,4-a)phthalazin-6-amine, N,N-bis(2-methoxyethyl)-3-(4-fluorophenyl)-
RN: 113628-68-5
InChIKey: JJHVPUJMJFVQMB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H22-F-N5-O2

Molecular Weight

  • 395.4358
 
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Names and Synonyms

Synonyms

  • BRN 6445480
  • N,N-Bis(2-methoxyethyl)-3-(4-fluorophenyl)-1,2,4-triazolo(3,4-a)phthalazin-6-amine

Systematic Name

  • 1,2,4-Triazolo(3,4-a)phthalazin-6-amine, N,N-bis(2-methoxyethyl)-3-(4-fluorophenyl)-

Registry Numbers

CAS Registry Number

  • 113628-68-5

System Generated Number

  • 0113628685

Structure Descriptors

InChI

1S/C21H22FN5O2/c1-28-13-11-26(12-14-29-2)21-18-6-4-3-5-17(18)20-24-23-19(27(20)25-21)15-7-9-16(22)10-8-15/h3-10H,11-14H2,1-2H3

InChIKey

JJHVPUJMJFVQMB-UHFFFAOYSA-N

Smiles

COCCN(CCOC)c1c2ccccc2c3nnc(n3n1)c4ccc(cc4)F

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.