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Substance Name: 1H-Pyrrole-3-carboxamide, 2,5-dihydro-N-(3-(((2-(phenylmethyloxy)phenyl)methyl)amino)propyl)-2,2,5,5-tetramethyl-, dihydrochloride
RN: 102131-95-3
InChIKey: VCOIFXFJAOIEKF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H35-N3-O2.2Cl-H

Molecular Weight

  • 494.5033
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 102131-95-3

System Generated Number

  • 0102131953

Molecular Formulas

Molecular Formula

  • C26-H35-N3-O2.2Cl-H

Molecular Formula Fragments

  • C26-H35-N3-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C26H35N3O2.2ClH/c1-25(2)17-22(26(3,4)29-25)24(30)28-16-10-15-27-18-21-13-8-9-14-23(21)31-19-20-11-6-5-7-12-20;;/h5-9,11-14,17,27,29H,10,15-16,18-19H2,1-4H3,(H,28,30);2*1H

InChIKey

VCOIFXFJAOIEKF-UHFFFAOYSA-N

Smiles

CC1(C=C(C(N1)(C)C)C(=O)NCCCNCc2ccccc2OCc3ccccc3)C.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 9mg/kg (9mg/kg)   Journal of Medicinal Chemistry. Vol. 29, Pg. 1138, 1986.