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Substance Name: Butyrophenone, 4-(4-(2-pyridyl)piperazinyl)-3',4',5'-trimethoxy-, dihydrochloride
RN: 16785-30-1
InChIKey: CIWJKMWPLBHARK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H29-N3-O4.2Cl-H

Molecular Weight

  • 472.41
 
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Names and Synonyms

Synonyms

  • 1-(2-Pyridyl)-4-(3-(3,4,5-trimethoxybenzoyl)propyl)piperazine dihydrochloirde
  • 4-(4-(2-Pyridyl)piperazinyl)-3',4',5'-trimethoxybutyrophenone dihydrochloride
  • Piperazine, 1-(2-pyridyl)-4-(3-(3,4,5-trimethoxybenzoyl)propyl)-, dihydrochloride

Systematic Name

  • Butyrophenone, 4-(4-(2-pyridyl)piperazinyl)-3',4',5'-trimethoxy-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 16785-30-1

System Generated Number

  • 0016785301

Molecular Formulas

Molecular Formula

  • C22-H29-N3-O4.2Cl-H

Molecular Formula Fragments

  • C22-H29-N3-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H29N3O4.2ClH/c1-27-19-15-17(16-20(28-2)22(19)29-3)18(26)7-6-10-24-11-13-25(14-12-24)21-8-4-5-9-23-21;;/h4-5,8-9,15-16H,6-7,10-14H2,1-3H3;2*1H

InChIKey

CIWJKMWPLBHARK-UHFFFAOYSA-N

Smiles

c1(cc(c(OC)c(c1)OC)OC)C(CCC[NH+]1CCN(c2cccc[n+]2)CC1)=O.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Journal of Medicinal Chemistry. Vol. 11, Pg. 332, 1968.