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Substance Name: 3-Pyridinecarbamic acid, 2-amino-6-((1,2-diphenylethyl)amino)-, ethyl ester, monohydrochloride
RN: 33400-47-4
InChIKey: XQWVQRJTEUTZRV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H24-N4-O2.Cl-H

Molecular Weight

  • 412.918
 
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Names and Synonyms

Synonyms

  • D-10,242
  • EINECS 251-497-8

Systematic Names

  • 3-Pyridinecarbamic acid, 2-amino-6-((1,2-diphenylethyl)amino)-, ethyl ester, monohydrochloride
  • Ethyl (2-amino-6-((1,2-diphenylethyl)amino)pyridin-3-yl)carbamate monohydrochloride

Registry Numbers

CAS Registry Number

  • 33400-47-4

System Generated Number

  • 0033400474

Molecular Formulas

Molecular Formula

  • C22-H24-N4-O2.Cl-H

Molecular Formula Fragments

  • C22-H24-N4-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H24N4O2.ClH/c1-2-28-22(27)25-18-13-14-20(26-21(18)23)24-19(17-11-7-4-8-12-17)15-16-9-5-3-6-10-16;/h3-14,19H,2,15H2,1H3,(H,25,27)(H3,23,24,26);1H

InChIKey

XQWVQRJTEUTZRV-UHFFFAOYSA-N

Smiles

C(Nc1c(nc(cc1)N[C@@H](Cc1ccccc1)c1ccccc1)N)(=O)OCC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 oral 40mg/kg (40mg/kg)   Drugs of the Future. Vol. 7, Pg. 801, 1982.
mouse LD50 oral 295mg/kg (295mg/kg)   Drugs of the Future. Vol. 7, Pg. 801, 1982.
rat LD50 oral 163mg/kg (163mg/kg)   Drugs of the Future. Vol. 7, Pg. 801, 1982.