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Substance Name: 2-Propanol, 1-(2-isopropyl-5-methylphenoxy)-3-(4-phenylpiperazinyl)-, dihydrochloride
RN: 63716-14-3
InChIKey: MKMDMYXUXRAIMQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H32-N2-O2.2Cl-H

Molecular Weight

  • 441.44
 
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Names and Synonyms

Synonym

  • 1-Piperazineethanol, alpha-((2-isopropyl-5-methylphenoxy)methyl)-4-phenyl-, dihydrochloride

Systematic Name

  • 2-Propanol, 1-(2-isopropyl-5-methylphenoxy)-3-(4-phenylpiperazinyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 63716-14-3

System Generated Number

  • 0063716143

Molecular Formulas

Molecular Formula

  • C23-H32-N2-O2.2Cl-H

Molecular Formula Fragments

  • C23-H32-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H32N2O2.2ClH/c1-18(2)22-10-9-19(3)15-23(22)27-17-21(26)16-24-11-13-25(14-12-24)20-7-5-4-6-8-20;;/h4-10,15,18,21,26H,11-14,16-17H2,1-3H3;2*1H

InChIKey

MKMDMYXUXRAIMQ-UHFFFAOYSA-N

Smiles

N1(CCN(CC1)C[C@@H](COc1c(ccc(c1)C)C(C)C)O)c1ccccc1.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS
Journal of Medicinal Chemistry. Vol. 16, Pg. 797, 1973.