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Substance Name: Uracil, 3-allyl-5-(dimethylamino)-6-methyl-1-phenyl-
RN: 32150-60-0
InChIKey: IDKUACLJPBLSHH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H19-N3-O2

Molecular Weight

  • 285.345
 
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Names and Synonyms

Synonyms

  • 2,4(1H,3H)-Pyrimidinedione, 3-allyl-5-dimethylamino-6-methyl-1-phenyl-
  • 3-Allyl-5-dimethylamino-6-methyl-1-phenyluracil
  • 5-25-15-00490 (Beilstein Handbook Reference)
  • BRN 0755011

Systematic Name

  • Uracil, 3-allyl-5-(dimethylamino)-6-methyl-1-phenyl-

Registry Numbers

CAS Registry Number

  • 32150-60-0

System Generated Number

  • 0032150600

Structure Descriptors

InChI

1S/C16H19N3O2/c1-5-11-18-15(20)14(17(3)4)12(2)19(16(18)21)13-9-7-6-8-10-13/h5-10H,1,11H2,2-4H3

InChIKey

IDKUACLJPBLSHH-UHFFFAOYSA-N

Smiles

c1(n(c(c(c(n1c1ccccc1)C)N(C)C)=O)CC=C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 835mg/kg (835mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 471, 1972.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.98 (none)   EXP
Water Solubility 304 mg/L 25 EST
Vapor Pressure 3.50E-09 mm Hg 25 EST
Henry's Law Constant 4.17E-11 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.26E-10 cm3/molecule-sec 25 EST

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