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Substance Name: 1H-Azepine, hexahydro-1-(3-(4-(2-pyridinyl)-1-piperazinyl)propyl)-, ethanedioate (1:1)
RN: 103840-67-1
InChIKey: MEUBHQAGRODBIJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H30-N4.C2-H2-O4

Molecular Weight

  • 392.4968
 
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Names and Synonyms

Synonym

  • Hexahydro-1-(3-(4-(2-pyridinyl)-1-piperazinyl)propyl)-1H-azepine ethanedioate (1:1)

Systematic Name

  • 1H-Azepine, hexahydro-1-(3-(4-(2-pyridinyl)-1-piperazinyl)propyl)-, ethanedioate (1:1)

Registry Numbers

CAS Registry Number

  • 103840-67-1

System Generated Number

  • 0103840671

Molecular Formulas

Molecular Formula

  • C18-H30-N4.C2-H2-O4

Molecular Formula Fragments

  • C18-H30-N4
  • C2-H2-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C18H30N4.C2H2O4/c1-2-6-11-20(10-5-1)12-7-13-21-14-16-22(17-15-21)18-8-3-4-9-19-18;3-1(4)2(5)6/h3-4,8-9H,1-2,5-7,10-17H2;(H,3,4)(H,5,6)

InChIKey

MEUBHQAGRODBIJ-UHFFFAOYSA-N

Smiles

c1ccnc(c1)N2CCN(CC2)CCCN3CCCCCC3.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 74mg/kg (74mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
United States Patent Document. Vol. #4673675,