2-(5-Amino-6-Oxo-2-Phenylpyrimidin-1(6H)-Yl)-N-[(2R)-1-(5-Tert-Butyl-1,3,4-Oxadiazol-2-Yl)-3-Methyl-1-Oxobutan-2-Yl]Acetamide

Molecule SVG Image

Properties Simple | Detailed

Formula C23H28N6O4
IUPAC Name 2-(5-amino-6-oxo-2-phenyl-pyrimidin-1-yl)-n-[(1r)-1-(5-tert-butyl-1,3,4-oxadiazole-2-carbonyl)-2-methyl-propyl]acetamide
Molecular Mass 452.506 g·mol−1
Heat of Formation -351.3 ± 16.7 kJ·mol−1
Dipole Moment 4.14 ± 1.08 D
Volume 549.82 Å 3
Surface Area 430.32 Å 2
HOMO Energy -8.40 ± 0.55 eV
LUMO Energy 1.91 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(5-amino-6-keto-2-phenyl-pyrimidin-1-yl)-n-[(1r)-1-(5-tert-butyl1,3,4-oxadiazole-2-carbonyl)-2-methyl-propyl]acetamide
  • 2-(5-amino-6-oxo-2-phenyl-1-pyrimidinyl)-n-[(1r)-1-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)-oxomethyl]-2-methylpropyl]acetamide
  • 2-(5-amino-6-oxo-2-phenyl-pyrimidin-1-yl)-n-[(1r)-1-(5-tert-butyl1,3,4-oxadiazole-2-carbonyl)-2-methyl-propyl]acetamide
  • 2-(5-amino-6-oxo-2-phenyl-pyrimidin-1-yl)-n-[(2r)-1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-3-methyl-1-oxo-butan-2-yl]ethanamide
InChIKey YSIHYROEMJSOAS-QGZVFWFLSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N