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Substance Name: 1H-Imidazole-1-propanoic acid, 4,5-dihydro-4-((4-chlorophenyl)methylene)-2-methyl-5-oxo-, compd. with piperazine (2:1)
RN: 73043-43-3
InChIKey: PZZJWGKRTWKDEK-RUKDNINCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C28-H26-Cl2-N4-O6.C4-H10-N2

Molecular Weight

  • 671.5784
 
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Names and Synonyms

  • 1H-Imidazole-1-propanoic acid, 4,5-dihydro-4-((4-chlorophenyl)methylene)-2-methyl-5-oxo-, compd. with piperazine (2:1)

Registry Numbers

CAS Registry Number

  • 73043-43-3

System Generated Number

  • 0073043433

Molecular Formulas

Molecular Formula

  • C28-H26-Cl2-N4-O6.C4-H10-N2

Molecular Formula Fragments

  • C28-H26-Cl2-N4-O6
  • C4-H10-N2
  • COMPONENT

Structure Descriptors

InChI

1S/2C14H13ClN2O3.C4H10N2/c2*1-9-16-12(8-10-2-4-11(15)5-3-10)14(20)17(9)7-6-13(18)19;1-2-6-4-3-5-1/h2*2-5,8H,6-7H2,1H3,(H,18,19);5-6H,1-4H2/b2*12-8+;

InChIKey

PZZJWGKRTWKDEK-RUKDNINCSA-N

Smiles

CC1=N/C(=C/c2ccc(cc2)Cl)/C(=O)N1CCC(=O)O.CC1=N/C(=C/c2ccc(cc2)Cl)/C(=O)N1CCC(=O)O.C1NCCNC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 800mg/kg (800mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Journal of the Indian Chemical Society. Vol. 56, Pg. 627, 1979.