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Substance Name: 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(alpha-methylphenethyl)hydrazide
RN: 60789-89-1
InChIKey: BYBUKOLWVLGTJF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H17-N3-O2

Molecular Weight

  • 259.307
 
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Names and Synonyms

Synonyms

  • 1-(alpha-Methylphenethyl)-2-(5-methyl-3-isoxazolylcarbonyl)hydrazine
  • 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(1-methyl-2-phenylethyl)hydrazide
  • 5-Methyl-3-isoxazolecarboxylic acid 2-(alpha-methylphenethyl)hydrazide
  • Hydrazine, 2-(5-methyl-3-isoxazolylcarbonyl)-1-(alpha-methylphenethyl)-
  • Ro 5-1226

Systematic Name

  • 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(alpha-methylphenethyl)hydrazide

Registry Numbers

CAS Registry Number

  • 60789-89-1

System Generated Number

  • 0060789891

Structure Descriptors

InChI

1S/C14H17N3O2/c1-10(8-12-6-4-3-5-7-12)15-16-14(18)13-9-11(2)19-17-13/h3-7,9-10,15H,8H2,1-2H3,(H,16,18)

InChIKey

BYBUKOLWVLGTJF-UHFFFAOYSA-N

Smiles

c1(cc(C)on1)C(NN[C@@H](Cc1ccccc1)C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   Journal of Medicinal and Pharmaceutical Chemistry. Vol. 2, Pg. 133, 1960.
rat LD50 intraperitoneal 94mg/kg (94mg/kg)   "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972Vol. -, Pg. 296, 1972.
rat LD50 oral 89mg/kg (89mg/kg)   "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and D.H. Efron, Washington, DC, 1972Vol. -, Pg. 296, 1972.