Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Ethanone, 1-(2,6-bis(3-(3,6-dihydro-4-phenyl-1(2H)-pyridinyl)-2-hydroxypropoxy)phenyl)-
RN: 87049-32-9
InChIKey: IFPSGWCELGTZTE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C36-H42-N2-O5

Molecular Weight

  • 582.737
 
* 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

Synonyms

  • 1-(2,6-Bis(3-(3,6-dihydro-4-phenyl-1(2H)-pyridinyl)-2-hydroxypropoxy)phenyl)ethanone
  • BRN 4620971

Systematic Name

  • Ethanone, 1-(2,6-bis(3-(3,6-dihydro-4-phenyl-1(2H)-pyridinyl)-2-hydroxypropoxy)phenyl)-

Registry Numbers

CAS Registry Number

  • 87049-32-9

System Generated Number

  • 0087049329

Structure Descriptors

InChI

1S/C36H42N2O5/c1-27(39)36-34(42-25-32(40)23-37-19-15-30(16-20-37)28-9-4-2-5-10-28)13-8-14-35(36)43-26-33(41)24-38-21-17-31(18-22-38)29-11-6-3-7-12-29/h2-15,17,32-33,40-41H,16,18-26H2,1H3

InChIKey

IFPSGWCELGTZTE-UHFFFAOYSA-N

Smiles

c1(c(c(OC[C@@H](C[N@@]2CCC(c3ccccc3)=CC2)O)ccc1)C(C)=O)OC[C@@H](C[N@@]1CCC(c2ccccc2)=CC1)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 681mg/kg (681mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 22, Pg. 140, 1983.