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Substance Name: Quinazoline, 4-(heptyloxy)-2-(4-methyl-1-piperazinyl)-, (E)-2-butenedioate (1:1)
RN: 129664-08-0
InChIKey: MFZIUMMYXBHTPR-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H30-N4-O.C4-H4-O4

Molecular Weight

  • 458.5556
 
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Names and Synonyms

Synonym

  • 4-Heptyloxy-2-(4-methyl-1-piperazinyl)quinazoline fumarate

Systematic Name

  • Quinazoline, 4-(heptyloxy)-2-(4-methyl-1-piperazinyl)-, (E)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 129664-08-0

System Generated Number

  • 0129664080

Molecular Formulas

Molecular Formula

  • C20-H30-N4-O.C4-H4-O4

Molecular Formula Fragments

  • C20-H30-N4-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C20H30N4O.C4H4O4/c1-3-4-5-6-9-16-25-19-17-10-7-8-11-18(17)21-20(22-19)24-14-12-23(2)13-15-24;5-3(6)1-2-4(7)8/h7-8,10-11H,3-6,9,12-16H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

MFZIUMMYXBHTPR-WLHGVMLRSA-N

Smiles

CCCCCCCOc1c2ccccc2nc(n1)N3CCN(CC3)C.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 325mg/kg (325mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 38, Pg. 1286, 1990.