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Substance Name: 1-Piperazineethanol, 4-(2-(o-methylsulfonylphenyl)imidazo(1,2-a)pyrimidin-3-yl)methyl-
RN: 3458-58-0
InChIKey: JPXPOSJCHBLQLJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H25-N5-O3-S

Molecular Weight

  • 415.516
 
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Names and Synonyms

Synonyms

  • 2-(o-Methylsulfonylphenyl)-3-(4-hydroxyethyl-1-piperazinylmethyl)imidazo(1,2-a)pyrimidine
  • 4-(2-(o-Methylsulfonylphenyl)imidazo(1,2-a)pyrimidin-3-yl)methyl-1-piperazineethanol
  • Imidazo(1,2-a)pyrimidine,3-(4(2-hydroxyethyl)piperazinylmethyl)-2-(o-methylsulfonylphenyl)-

Systematic Name

  • 1-Piperazineethanol, 4-(2-(o-methylsulfonylphenyl)imidazo(1,2-a)pyrimidin-3-yl)methyl-

Registry Numbers

CAS Registry Number

  • 3458-58-0

System Generated Number

  • 0003458580

Structure Descriptors

InChI

1S/C20H25N5O3S/c1-29(27,28)18-6-3-2-5-16(18)19-17(25-8-4-7-21-20(25)22-19)15-24-11-9-23(10-12-24)13-14-26/h2-8,26H,9-15H2,1H3

InChIKey

JPXPOSJCHBLQLJ-UHFFFAOYSA-N

Smiles

N1(CCN(CC1)Cc1c(nc2ncccn12)c1c(cccc1)S(=O)(=O)C)CCO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500mg/kg (500mg/kg) BEHAVIORAL: TREMOR

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Medicinal Chemistry. Vol. 9, Pg. 29, 1966.