Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1-Piperazinepropanamide, N-(3-(dimethylamino)phenyl)-4-(diphenylmethyl)-, hydrochloride, hydrate (2:6:1)
RN: 107314-65-8
InChIKey: KCTWQKRPKKNLBF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C28-H34-N4-O.3Cl-H.1/2H2-O

Molecular Weight

  • 551.9863
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • 3-(4-Benzhydryl-1-piperazinyl)-N-(3-dimethylaminophenyl)propionamide trihydrochloride 1/2H2O

Systematic Name

  • 1-Piperazinepropanamide, N-(3-(dimethylamino)phenyl)-4-(diphenylmethyl)-, hydrochloride, hydrate (2:6:1)

Registry Numbers

CAS Registry Number

  • 107314-65-8

System Generated Number

  • 0107314658

Molecular Formulas

Molecular Formula

  • C28-H34-N4-O.3Cl-H.1/2H2-O

Molecular Formula Fragments

  • C28-H34-N4-O
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C28H34N4O.3ClH/c1-30(2)26-15-9-14-25(22-26)29-27(33)16-17-31-18-20-32(21-19-31)28(23-10-5-3-6-11-23)24-12-7-4-8-13-24;;;/h3-15,22,28H,16-21H2,1-2H3,(H,29,33);3*1H

InChIKey

KCTWQKRPKKNLBF-UHFFFAOYSA-N

Smiles

CN(C)c1cccc(c1)NC(=O)CCN2CCN(CC2)C(c3ccccc3)c4ccccc4.Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 146mg/kg (146mg/kg)   United States Patent Document. Vol. #4675319,
mouse LD50 oral 191mg/kg (191mg/kg)   United States Patent Document. Vol. #4675319,