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Substance Name: 1-Piperazineethanol, beta-(o-chlorophenyl)-4-(p-methoxybenzyl)-alpha-phenyl-, dihydrochloride, erythro-
RN: 74037-80-2
InChIKey: DVHWCHJHMIUEDI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H29-Cl-N2-O2.2Cl-H

Molecular Weight

  • 509.9019
 
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Names and Synonyms

  • 1-Piperazineethanol, beta-(o-chlorophenyl)-4-(p-methoxybenzyl)-alpha-phenyl-, dihydrochloride, erythro-

Registry Numbers

CAS Registry Number

  • 74037-80-2

Related Registry Number

  • 57779-29-0 (Parent)

System Generated Number

  • 0074037802

Molecular Formulas

Molecular Formula

  • C26-H29-Cl-N2-O2.2Cl-H

Molecular Formula Fragments

  • C26-H29-Cl-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C26H29ClN2O2.2ClH/c1-31-22-13-11-20(12-14-22)19-28-15-17-29(18-16-28)25(23-9-5-6-10-24(23)27)26(30)21-7-3-2-4-8-21;;/h2-14,25-26,30H,15-19H2,1H3;2*1H

InChIKey

DVHWCHJHMIUEDI-UHFFFAOYSA-N

Smiles

COc1ccc(cc1)CN2CCN(CC2)C(c3ccccc3Cl)C(c4ccccc4)O.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 509mg/kg (509mg/kg) BEHAVIORAL: ANALGESIA Journal of Medicinal Chemistry. Vol. 22, Pg. 58, 1979.
mouse LD50 subcutaneous 430mg/kg (430mg/kg) BEHAVIORAL: ANALGESIA Journal of Medicinal Chemistry. Vol. 22, Pg. 58, 1979.
rat LD50 oral > 3200mg/kg (3200mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 58, 1979.
rat LD50 subcutaneous 584mg/kg (584mg/kg) BEHAVIORAL: ANALGESIA Journal of Medicinal Chemistry. Vol. 22, Pg. 58, 1979.