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Substance Name: 3,8-Diazabicyclo(3.2.1)octane-3-propanimine, N-((((4-methoxyphenyl)amino)carbonyl)oxy)-8-(1-oxopropyl)-alpha-phenyl-, monohydrochloride
RN: 97669-74-4
InChIKey: JPTRDBUAJCAOBA-JTCQIRNMSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H32-N4-O4.Cl-H

Molecular Weight

  • 501.0237
 
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Names and Synonyms

  • 3,8-Diazabicyclo(3.2.1)octane-3-propanimine, N-((((4-methoxyphenyl)amino)carbonyl)oxy)-8-(1-oxopropyl)-alpha-phenyl-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 97669-74-4

System Generated Number

  • 0097669744

Molecular Formulas

Molecular Formula

  • C26-H32-N4-O4.Cl-H

Molecular Formula Fragments

  • C26-H32-N4-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C26H32N4O4.ClH/c1-3-25(31)30-21-11-12-22(30)18-29(17-21)24(19-7-5-4-6-8-19)15-16-27-34-26(32)28-20-9-13-23(33-2)14-10-20;/h4-10,13-14,16,21-22,24H,3,11-12,15,17-18H2,1-2H3,(H,28,32);1H/b27-16+;

InChIKey

JPTRDBUAJCAOBA-JTCQIRNMSA-N

Smiles

N1(CC2N(C(C1)CC2)C(=O)CC)C(c1ccccc1)C/C=N/OC(=O)Nc1ccc(cc1)OC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Farmaco, Edizione Scientifica. Vol. 40, Pg. 86, 1985.