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Substance Name: 1-Piperazinepropanamide, 4-(diphenylmethyl)-N-(4-(((methylamino)carbonyl)amino)phenyl)-
RN: 107314-45-4
InChIKey: JOCRUALROAETRI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C28-H33-N5-O2

Molecular Weight

  • 471.6017
 
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Names and Synonyms

Synonyms

  • 3-(4-Benzhydryl-1-piperazinyl)-N-(4-methylureidophenyl)propionamide
  • 4-(Diphenylmethyl)-N-(4-(((methylamino)carbonyl)amino)phenyl)-1-piperazinepropanamide

Systematic Name

  • 1-Piperazinepropanamide, 4-(diphenylmethyl)-N-(4-(((methylamino)carbonyl)amino)phenyl)-

Registry Numbers

CAS Registry Number

  • 107314-45-4

System Generated Number

  • 0107314454

Structure Descriptors

InChI

1S/C28H33N5O2/c1-30-28(35)31-23-12-14-24(15-13-23)33-19-18-32(17-16-26(29)34)25(20-33)27(21-8-4-2-5-9-21)22-10-6-3-7-11-22/h2-15,25,27H,16-20H2,1H3,(H2,29,34)(H2,30,31,35)

InChIKey

JOCRUALROAETRI-UHFFFAOYSA-N

Smiles

CNC(=O)Nc1ccc(cc1)N2CCN(C(C2)C(c3ccccc3)c4ccccc4)CCC(=O)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 825mg/kg (825mg/kg)   United States Patent Document. Vol. #4675319,
mouse LD50 oral > 2782mg/kg (2782mg/kg)   United States Patent Document. Vol. #4675319,