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Substance Name: 3-Pyridineacrylic acid, 2-(4-(p-tolyl)-1-piperazinyl)ethyl ester
RN: 4415-55-8
InChIKey: VKOHPEROCISETA-RMKNXTFCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H25-N3-O2

Molecular Weight

  • 351.448
 
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Names and Synonyms

Synonyms

  • 1-Piperazineethanol, 4-(p-tolyl)-, 3-pyridineacrylate (ester)
  • 2-(4-(p-Tolyl)-1-piperazinyl)ethyl 3-pyridineacrylate
  • 2-Propenoic acid, 3-(3-pyridinyl)-, 2-(4-(4-methylphenyl)-1-piperazinyl)ethyl ester
  • BRN 0838804

Systematic Name

  • 3-Pyridineacrylic acid, 2-(4-(p-tolyl)-1-piperazinyl)ethyl ester

Registry Numbers

CAS Registry Number

  • 4415-55-8

System Generated Number

  • 0004415558

Structure Descriptors

InChI

1S/C21H25N3O2/c1-18-4-7-20(8-5-18)24-13-11-23(12-14-24)15-16-26-21(25)9-6-19-3-2-10-22-17-19/h2-10,17H,11-16H2,1H3/b9-6+

InChIKey

VKOHPEROCISETA-RMKNXTFCSA-N

Smiles

C(\C=C\c1cnccc1)(=O)OCCN1CCN(CC1)c1ccc(cc1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 350mg/kg (350mg/kg) SENSE ORGANS AND SPECIAL SENSES: OTHER: EYE

BEHAVIORAL: ANALGESIA

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
Journal of Pharmaceutical Sciences. Vol. 55, Pg. 290, 1966.