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Substance Name: DL-Phenylalanine, 4-(bis(2-chloroethyl)amino)-N-DL-norleucyl-, ethyl ester, monohydrobromide
RN: 68524-13-0
InChIKey: KQTGROWVKABRCW-HLRBRJAUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H33-Cl2-N3-O3.Br-H

Molecular Weight

  • 527.3276
 
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Names and Synonyms

Synonym

  • 4-(Bis(2-chloroethyl)amino)-N-DL-norleucyl-DL-phenylalanine ethyl ester monohydrobromide

Systematic Name

  • DL-Phenylalanine, 4-(bis(2-chloroethyl)amino)-N-DL-norleucyl-, ethyl ester, monohydrobromide

Registry Numbers

CAS Registry Number

  • 68524-13-0

System Generated Number

  • 0068524130

Molecular Formulas

Molecular Formula

  • C21-H33-Cl2-N3-O3.Br-H

Molecular Formula Fragments

  • Br-H
  • C21-H33-Cl2-N3-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C21H33Cl2N3O3.BrH/c1-3-5-6-18(24)20(27)25-19(21(28)29-4-2)15-16-7-9-17(10-8-16)26(13-11-22)14-12-23;/h7-10,18-19H,3-6,11-15,24H2,1-2H3,(H,25,27);1H/t18-,19-;/m0./s1

InChIKey

KQTGROWVKABRCW-HLRBRJAUSA-N

Smiles

CCCC[C@@H](C(=O)N[C@@H](Cc1ccc(cc1)N(CCCl)CCCl)C(=O)OCC)N.Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 40mg/kg (40mg/kg)   Biologicheskii Zhurnal Armenii. Biological Journal of Armenia. Vol. 31, Pg. 405, 1978.