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Substance Name: 1H-Pyrrole-3-carboxamide, 2,5-dihydro-N-(3-((o-(carbamoylmethoxy)benzyl)amino)propyl)-2,2,5,5-tetramethyl-, dihydrochloride
RN: 102132-01-4
InChIKey: UQXMZRKERQYAGC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H32-N4-O3.2Cl-H

Molecular Weight

  • 461.4306
 
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Names and Synonyms

  • 1H-Pyrrole-3-carboxamide, 2,5-dihydro-N-(3-((o-(carbamoylmethoxy)benzyl)amino)propyl)-2,2,5,5-tetramethyl-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 102132-01-4

System Generated Number

  • 0102132014

Molecular Formulas

Molecular Formula

  • C21-H32-N4-O3.2Cl-H

Molecular Formula Fragments

  • C21-H32-N4-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H32N4O3.2ClH/c1-20(2)12-16(21(3,4)25-20)19(27)24-11-7-10-23-13-15-8-5-6-9-17(15)28-14-18(22)26;;/h5-6,8-9,12,23,25H,7,10-11,13-14H2,1-4H3,(H2,22,26)(H,24,27);2*1H

InChIKey

UQXMZRKERQYAGC-UHFFFAOYSA-N

Smiles

CC1(C=C(C(N1)(C)C)C(=O)NCCCNCc2ccccc2OCC(=O)N)C.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 10mg/kg (10mg/kg)   Journal of Medicinal Chemistry. Vol. 29, Pg. 1138, 1986.