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Substance Name: Hydrocinnamamide, alpha-((p-chlorobenzoyl)amino)-N,N-dipropyl-4-(2-(4-methyl-1-piperazinyl)ethoxy)-, citrate, (+-)-
RN: 57228-01-0
InChIKey: VGVLFWGODCGJHX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H41-Cl-N4-O3.C6-H8-O7

Molecular Weight

  • 721.243
 
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Names and Synonyms

Synonyms

  • CR 733
  • O-(2'-(N''-Methylpiperazine)-N'-ethyl)-N-(p-chlorobenzoyl)-DL-tyrosyldi-n-propylamide citrate

Systematic Names

  • Benzenepropanamide, alpha-((4-chlorobenzoyl)amino)-4-(2-(4-methyl-1-piperazinyl)ethoxy)-N,N-dipropyl-, 2-hydroxy-1,2,3-propanetricarboxylate
  • Hydrocinnamamide, alpha-((p-chlorobenzoyl)amino)-N,N-dipropyl-4-(2-(4-methyl-1-piperazinyl)ethoxy)-, citrate, (+-)-

Registry Numbers

CAS Registry Number

  • 57228-01-0

System Generated Number

  • 0057228010

Molecular Formulas

Molecular Formula

  • C29-H41-Cl-N4-O3.C6-H8-O7

Molecular Formula Fragments

  • C29-H41-Cl-N4-O3
  • C6-H8-O7
  • COMPONENT

Structure Descriptors

InChI

1S/C29H41ClN4O3.C6H8O7/c1-4-14-34(15-5-2)29(36)27(31-28(35)24-8-10-25(30)11-9-24)22-23-6-12-26(13-7-23)37-21-20-33-18-16-32(3)17-19-33;7-3(8)1-6(13,5(11)12)2-4(9)10/h6-13,27H,4-5,14-22H2,1-3H3,(H,31,35);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)

InChIKey

VGVLFWGODCGJHX-UHFFFAOYSA-N

Smiles

C([C@@H](C(N(CCC)CCC)=O)NC(c1ccc(cc1)Cl)=O)c1ccc(cc1)OCCN1CCN(C)CC1.C(CC(O)=O)(CC(O)=O)(C(O)=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 43500ug/kg (43.5mg/kg)   United States Patent Document. Vol. #4004008,