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Substance Name: Quinazoline, 4-(pentyloxy)-2-(4-pentyl-1-piperazinyl)-, (E)-2-butenedioate (1:1)
RN: 129664-02-4
InChIKey: MGXJLXUJKMNPEU-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H34-N4-O.C4-H4-O4

Molecular Weight

  • 486.6092
 
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Names and Synonyms

Synonym

  • 2-(4-Pentyl-1-piperazinyl)-4-pentyloxyquinazoline fumarate

Systematic Name

  • Quinazoline, 4-(pentyloxy)-2-(4-pentyl-1-piperazinyl)-, (E)-2-butenedioate (1:1)

Registry Numbers

CAS Registry Number

  • 129664-02-4

System Generated Number

  • 0129664024

Molecular Formulas

Molecular Formula

  • C22-H34-N4-O.C4-H4-O4

Molecular Formula Fragments

  • C22-H34-N4-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C22H34N4O.C4H4O4/c1-3-5-9-13-25-14-16-26(17-15-25)22-23-20-12-8-7-11-19(20)21(24-22)27-18-10-6-4-2;5-3(6)1-2-4(7)8/h7-8,11-12H,3-6,9-10,13-18H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

MGXJLXUJKMNPEU-WLHGVMLRSA-N

Smiles

CCCCCN1CCN(CC1)c2nc3ccccc3c(n2)OCCCCC.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 38, Pg. 1286, 1990.