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Substance Name: 1-Propanone, 3-(4-(beta-methoxyphenethyl)-1-piperazinyl)-2-methyl-1-(2-thienyl)-, dihydrochloride
RN: 21263-06-9
InChIKey: BNQLBSGHXTUDSD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H28-N2-O2-S.2Cl-H

Molecular Weight

  • 445.452
 
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Names and Synonyms

  • 1-Propanone, 3-(4-(beta-methoxyphenethyl)-1-piperazinyl)-2-methyl-1-(2-thienyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 21263-06-9

System Generated Number

  • 0021263069

Molecular Formulas

Molecular Formula

  • C21-H28-N2-O2-S.2Cl-H

Molecular Formula Fragments

  • C21-H28-N2-O2-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H28N2O2S.2ClH/c1-17(21(24)20-9-6-14-26-20)15-22-10-12-23(13-11-22)16-19(25-2)18-7-4-3-5-8-18;;/h3-9,14,17,19H,10-13,15-16H2,1-2H3;2*1H

InChIKey

BNQLBSGHXTUDSD-UHFFFAOYSA-N

Smiles

C(=O)(c1cccs1)[C@@H](C)CN1CCN(CC1)C[C@@H](c1ccccc1)OC.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1250mg/kg (1250mg/kg)   United States Patent Document. Vol. #3448192,