Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Acetamide, N,N'-((2-hydroxy-1,3-propanediyl)bis(oxy-2,1-phenylene))bis(2-((phenylmethyl)amino)-, ethanedioate, hydrate (1:2:1)
RN: 121033-12-3
InChIKey: HIRLODSAFVVOBF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C33-H36-N4-O5.2C2-H2-O4.H2-O

Molecular Weight

  • 748.738
 
* 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

  • Acetamide, N,N'-((2-hydroxy-1,3-propanediyl)bis(oxy-2,1-phenylene))bis(2-((phenylmethyl)amino)-, ethanedioate, hydrate (1:2:1)

Registry Numbers

CAS Registry Number

  • 121033-12-3

System Generated Number

  • 0121033123

Molecular Formulas

Molecular Formula

  • C33-H36-N4-O5.2C2-H2-O4.H2-O

Molecular Formula Fragments

  • C2-H2-O4
  • C33-H36-N4-O5
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C33H36N4O5.2C2H2O4/c38-27(23-41-30-17-9-7-15-28(30)36-32(39)21-34-19-25-11-3-1-4-12-25)24-42-31-18-10-8-16-29(31)37-33(40)22-35-20-26-13-5-2-6-14-26;2*3-1(4)2(5)6/h1-18,27,34-35,38H,19-24H2,(H,36,39)(H,37,40);2*(H,3,4)(H,5,6)

InChIKey

HIRLODSAFVVOBF-UHFFFAOYSA-N

Smiles

c1ccc(cc1)CNCC(=O)Nc2ccccc2OCC(COc3ccccc3NC(=O)CNCc4ccccc4)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 340mg/kg (340mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
Scientia Pharmaceutica. Vol. 56, Pg. 211, 1988.