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Substance Name: 2(3H)-Furanone, dihydro-5-(4-chlorophenyl)-3-(4-methyl-1-piperazinyl)-, hydrochloride, hydrate (2:4:1)
RN: 139084-80-3
InChIKey: TUVFFDNZCUZBNH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H19-Cl-N2-O2.2Cl-H.1/2H2-O

Molecular Weight

  • 367.7019
 
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Names and Synonyms

  • 2(3H)-Furanone, dihydro-5-(4-chlorophenyl)-3-(4-methyl-1-piperazinyl)-, hydrochloride, hydrate (2:4:1)

Registry Numbers

CAS Registry Number

  • 139084-80-3

System Generated Number

  • 0139084803

Molecular Formulas

Molecular Formula

  • C15-H19-Cl-N2-O2.2Cl-H.1/2H2-O

Molecular Formula Fragments

  • C15-H19-Cl-N2-O2
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C15H19ClN2O2.2ClH/c1-17-6-8-18(9-7-17)13-10-14(20-15(13)19)11-2-4-12(16)5-3-11;;/h2-5,13-14H,6-10H2,1H3;2*1H

InChIKey

TUVFFDNZCUZBNH-UHFFFAOYSA-N

Smiles

CN1CCN(CC1)C2CC(OC2=O)c3ccc(cc3)Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 360mg/kg (360mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 43, Pg. 271, 1991.
mouse LD50 oral 1003mg/kg (1003mg/kg)   Polish Journal of Pharmacology and Pharmacy. Vol. 43, Pg. 271, 1991.