Methyl 5-(3,6-Dihydro-1(2H)-Pyridyl)-2-Oxo-2H-[1,2,4]Oxadiazolo[2,3-A]Pyrimidine-7-Carbamate

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Formula C12H13N5O4
IUPAC Name methyl n-[5-(3,6-dihydro-2h-pyridin-1-yl)-2-oxo-[1,2,4]oxadiazolo[2,3-a]pyrimidin-7-yl]carbamate
Molecular Mass 291.263 g·mol−1
Heat of Formation -210.7 ± 16.7 kJ·mol−1
Dipole Moment 9.53 ± 1.08 D
Volume 314.16 Å 3
Surface Area 294.69 Å 2
HOMO Energy -9.45 ± 0.55 eV
LUMO Energy 1.82 ± eV
Point Group Symmetry C1
Synonyms
  • carbamic acid, (5-(3,6-dihydro-1(2h)-pyridinyl)-2-oxo-2h-(1,2,4)oxadiazolo(2,3-a)pyrimidin-7-yl)-, methyl ester
  • carprazadil
  • carprazidil
  • methyl 5-(3,6-dihydro-1(2h)-pyridyl)-2-oxo-2h-(1,2,4)oxadiazolo(2,3-a)pyrimidine-7-carbamate
  • methyl n-[5-(3,6-dihydro-2h-pyridin-1-yl)-2-oxo-[1,2,4]oxadiazolo[3,2-b]pyrimidin-7-yl]carbamate
  • n-[5-(3,6-dihydro-2h-pyridin-1-yl)-2-keto-[1,2,4]oxadiazolo[3,2-b]pyrimidin-7-yl]carbamic acid methyl ester
  • n-[5-(3,6-dihydro-2h-pyridin-1-yl)-2-oxo-[1,2,4]oxadiazolo[3,2-b]pyrimidin-7-yl]carbamic acid methyl ester
  • ro 12-4713
  • ro-12-4713
CAS Number(s)
  • 68020-77-9
InChIKey LIQCCUFOYBAGQT-UHFFFAOYSA-N
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