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Substance Name: 4(3H)-Quinazolinone, 3-(4-(diethylamino)-2-butynyl)-7-methoxy-, oxalate (1:1)
RN: 35739-53-8
InChIKey: IGBYAICAZYMXFA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H21-N3-O2.C2-H2-O4

Molecular Weight

  • 389.406
 
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Names and Synonyms

Synonym

  • 3-(4-(Diethylamino)-2-butynyl)-7-methoxy-4(3H)-quinazolinone oxalate

Systematic Name

  • 4(3H)-Quinazolinone, 3-(4-(diethylamino)-2-butynyl)-7-methoxy-, oxalate (1:1)

Registry Numbers

CAS Registry Number

  • 35739-53-8

System Generated Number

  • 0035739538

Molecular Formulas

Molecular Formula

  • C17-H21-N3-O2.C2-H2-O4

Molecular Formula Fragments

  • C17-H21-N3-O2
  • C2-H2-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C17H21N3O2.C2H2O4/c1-4-19(5-2)10-6-7-11-20-13-18-16-12-14(22-3)8-9-15(16)17(20)21;3-1(4)2(5)6/h8-9,12-13H,4-5,10-11H2,1-3H3;(H,3,4)(H,5,6)

InChIKey

IGBYAICAZYMXFA-UHFFFAOYSA-N

Smiles

C(C(O)=O)(O)=O.C(CN(CC)CC)#CCn1c(c2c(cc(cc2)OC)nc1)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 41mg/kg (41mg/kg)   Acta Pharmaceutica Suecica. Vol. 8, Pg. 639, 1971.