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Substance Name: Propiophenone, 4'-(2-hydroxy-3-(4-(3,4-dimethoxyphenyl)piperazinyl)propoxy)-, dihydrochloride
RN: 63815-48-5
InChIKey: FZNPVRNXYVQHOC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H32-N2-O5.2Cl-H

Molecular Weight

  • 501.448
 
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Names and Synonyms

Synonyms

  • 3-(4-(3,4-Dimethoxyphenyl)piperazinyl)-1-(4-propionylphenoxy)propan-2-ol dihydrochloride
  • 4'-(2-Hydroxy-3-(4-(3,4-dimethoxyphenyl)piperazinyl)propoxy)propiophenone dihydrochloride

Systematic Name

  • Propiophenone, 4'-(2-hydroxy-3-(4-(3,4-dimethoxyphenyl)piperazinyl)propoxy)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 63815-48-5

System Generated Number

  • 0063815485

Molecular Formulas

Molecular Formula

  • C24-H32-N2-O5.2Cl-H

Molecular Formula Fragments

  • C24-H32-N2-O5
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C24H32N2O5.2ClH/c1-4-22(28)18-5-8-21(9-6-18)31-17-20(27)16-25-11-13-26(14-12-25)19-7-10-23(29-2)24(15-19)30-3;;/h5-10,15,20,27H,4,11-14,16-17H2,1-3H3;2*1H

InChIKey

FZNPVRNXYVQHOC-UHFFFAOYSA-N

Smiles

N1(c2cc(OC)c(cc2)OC)CCN(CC1)C[C@@H](COc1ccc(C(=O)CC)cc1)O.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 216mg/kg (216mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 286, 1972.