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Substance Name: 2(3H)-Oxazolone, 3-acetyl-4-(4-fluorophenyl)-5-(2-(4-(2-methoxyphenyl)-1-piperazinyl)ethyl)-,monohydrochloride
RN: 52868-05-0
InChIKey: VXILNDZEMUGYLY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H26-F-N3-O4.Cl-H

Molecular Weight

  • 475.9453
 
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Names and Synonyms

Synonym

  • 3-Acetyl-4-(4-fluorophenyl)-5-(2-(4-(2-methoxyphenyl)-1-piperazinyl)ethyl)-2(3H)-oxazolone HCl

Systematic Name

  • 2(3H)-Oxazolone, 3-acetyl-4-(4-fluorophenyl)-5-(2-(4-(2-methoxyphenyl)-1-piperazinyl)ethyl)-,monohydrochloride

Registry Numbers

CAS Registry Number

  • 52868-05-0

System Generated Number

  • 0052868050

Molecular Formulas

Molecular Formula

  • C24-H26-F-N3-O4.Cl-H

Molecular Formula Fragments

  • C24-H26-F-N3-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C24H26FN3O4.ClH/c1-17(29)28-23(18-7-9-19(25)10-8-18)22(32-24(28)30)11-12-26-13-15-27(16-14-26)20-5-3-4-6-21(20)31-2;/h3-10H,11-16H2,1-2H3;1H

InChIKey

VXILNDZEMUGYLY-UHFFFAOYSA-N

Smiles

CC(=O)n1c(c(oc1=O)CCN2CCN(CC2)c3ccccc3OC)c4ccc(cc4)F.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 190mg/kg (190mg/kg)   Journal of Medicinal Chemistry. Vol. 32, Pg. 2241, 1989.