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Substance Name: 2(3H)-Oxazolone, 4-(4-chlorophenyl)-5-(2-(4-(2-pyridinyl)-1-piperazinyl)ethyl)-, dihydrochloride
RN: 120944-25-4
InChIKey: MPVNEXQSHGYPQG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-Cl-N4-O2.2Cl-H

Molecular Weight

  • 457.7867
 
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Names and Synonyms

Synonym

  • 4-(4-Chlorophenyl)-5-(2-(4-(2-pyridinyl)-1-piperazinyl)ethyl)-2(3H)-oxazolone dihydrochloride

Systematic Name

  • 2(3H)-Oxazolone, 4-(4-chlorophenyl)-5-(2-(4-(2-pyridinyl)-1-piperazinyl)ethyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 120944-25-4

System Generated Number

  • 0120944254

Molecular Formulas

Molecular Formula

  • C20-H21-Cl-N4-O2.2Cl-H

Molecular Formula Fragments

  • C20-H21-Cl-N4-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H21ClN4O2.2ClH/c21-16-6-4-15(5-7-16)19-17(27-20(26)23-19)8-10-24-11-13-25(14-12-24)18-3-1-2-9-22-18;;/h1-7,9H,8,10-14H2,(H,23,26);2*1H

InChIKey

MPVNEXQSHGYPQG-UHFFFAOYSA-N

Smiles

c1ccnc(c1)N2CCN(CC2)CCc3c([nH]c(=O)o3)c4ccc(cc4)Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 375mg/kg (375mg/kg)   Journal of Medicinal Chemistry. Vol. 32, Pg. 2241, 1989.