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Substance Name: 1H-Pyrrole-3-carboxamide, 2,5-dihydro-N-(3-(((2-hydroxy-3-methoxyphenyl)methyl)amino)propyl)-2,2,5,5-tetramethyl-, dihydrochloride
RN: 102132-03-6
InChIKey: HALHBUNCKRAZJB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H31-N3-O3.2Cl-H

Molecular Weight

  • 434.4047
 
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Names and Synonyms

  • 1H-Pyrrole-3-carboxamide, 2,5-dihydro-N-(3-(((2-hydroxy-3-methoxyphenyl)methyl)amino)propyl)-2,2,5,5-tetramethyl-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 102132-03-6

System Generated Number

  • 0102132036

Molecular Formulas

Molecular Formula

  • C20-H31-N3-O3.2Cl-H

Molecular Formula Fragments

  • C20-H31-N3-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H31N3O3.2ClH/c1-19(2)12-15(20(3,4)23-19)18(25)22-11-7-10-21-13-14-8-6-9-16(26-5)17(14)24;;/h6,8-9,12,21,23-24H,7,10-11,13H2,1-5H3,(H,22,25);2*1H

InChIKey

HALHBUNCKRAZJB-UHFFFAOYSA-N

Smiles

CC1(C=C(C(N1)(C)C)C(=O)NCCCNCc2cccc(c2O)OC)C.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 26mg/kg (26mg/kg)   Journal of Medicinal Chemistry. Vol. 29, Pg. 1138, 1986.