Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Quinazoline, 4-(4-methylphenoxy)-2-(4-methyl-1-piperazinyl)-, (E)-2-butenedioate) (1:1)
RN: 129112-68-1
InChIKey: XNJKOHWMNRRRDB-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H22-N4-O.C4-H4-O4

Molecular Weight

  • 450.4924
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • 2-(4-Methyl-1-piperazinyl)-4-p-tolyloxyquinazoline fumarate

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 129112-68-1

System Generated Number

  • 0129112681

Molecular Formulas

Molecular Formula

  • C20-H22-N4-O.C4-H4-O4

Molecular Formula Fragments

  • C20-H22-N4-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C20H22N4O.C4H4O4/c1-15-7-9-16(10-8-15)25-19-17-5-3-4-6-18(17)21-20(22-19)24-13-11-23(2)12-14-24;5-3(6)1-2-4(7)8/h3-10H,11-14H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

XNJKOHWMNRRRDB-WLHGVMLRSA-N

Smiles

Cc1ccc(cc1)Oc2c3ccccc3nc(n2)N4CCN(CC4)C.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 800mg/kg (800mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 38, Pg. 681, 1990.