Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 2-Oxazolamine, 4,5-dihydro-5-((4-(4-methoxyphenyl)-3-methyl-1-piperazinyl)methyl)-
RN: 144881-48-1
InChIKey: SEGXVZIYBPMHEY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H24-N4-O2

Molecular Weight

  • 304.392
 
* 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

  • 4,5-Dihydro-5-((4-(4-methoxyphenyl)-3-methyl-1-piperazinyl)methyl)-2-oxazolamine
  • BRN 5449420

Systematic Name

  • 2-Oxazolamine, 4,5-dihydro-5-((4-(4-methoxyphenyl)-3-methyl-1-piperazinyl)methyl)-

Registry Numbers

CAS Registry Number

  • 144881-48-1

System Generated Number

  • 0144881481

Structure Descriptors

InChI

1S/C16H24N4O2/c1-2-21-15-6-4-3-5-14(15)20-9-7-19(8-10-20)12-13-11-18-16(17)22-13/h3-6,13H,2,7-12H2,1H3,(H2,17,18)

InChIKey

SEGXVZIYBPMHEY-UHFFFAOYSA-N

Smiles

C1(=NC[C@@H](O1)CN1CCN(CC1)c1c(OCC)cccc1)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 524mg/kg (524mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 27, Pg. 437, 1992.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.21 (none)   EXP
Water Solubility 1070 mg/L 25 EST
Vapor Pressure 7.79E-08 mm Hg 25 EST
Henry's Law Constant 9.06E-17 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.86E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.