Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrochloride, (E)-(-)-
RN: 5712-25-4
InChIKey: IGGNNRSCDQALLP-ZVWHLABXSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H16-N2-O.Cl-H

Molecular Weight

  • 252.743
 
* 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

  • (-)-trans-3-Imino-hexahydro-1-phenyl-3H-oxazolo(3,4-a)pyridine, hydrochloride

Systematic Name

  • 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-phenyl-, hydrochloride, (E)-(-)-

Registry Numbers

CAS Registry Number

  • 5712-25-4

System Generated Number

  • 0005712254

Molecular Formulas

Molecular Formula

  • C13-H16-N2-O.Cl-H

Molecular Formula Fragments

  • C13-H16-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H16N2O.ClH/c14-13-15-9-5-4-8-11(15)12(16-13)10-6-2-1-3-7-10;/h1-3,6-7,11-12,14H,4-5,8-9H2;1H/t11-,12+;/m0./s1

InChIKey

IGGNNRSCDQALLP-ZVWHLABXSA-N

Smiles

C1[C@@H]2N(CCC1)C(O[C@@H]2c1ccccc1)=N.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 12mg/kg (12mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 13, Pg. 127, 1978.
mouse LD50 oral 60mg/kg (60mg/kg) VASCULAR: BP ELEVATION NOT CHARACTERIZED IN AUTONOMIC SECTION

BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

AUTONOMIC NERVOUS SYSTEM: SYMPATHOMIMETIC
European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 15, Pg. 111, 1980.