(3R)-3-(2,3-Dihydro-1-Benzofuran-5-Yl)-2-[5-(4-Methoxyphenyl)Pyrimidin-2-Yl]-2,3-Dihydro-1H-Pyrrolo[3,4-B]Quinolin-9-Ol

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Properties Simple | Detailed

Formula C30H24N4O3
IUPAC Name (3r)-3-(2,3-dihydrobenzofuran-5-yl)-2-[5-(4-methoxyphenyl)pyrimidin-2-yl]-3,4-dihydro-1h-pyrrolo[3,4-b]quinolin-9-one
Molecular Mass 488.537 g·mol−1
Heat of Formation 98.5 ± 16.7 kJ·mol−1
Dipole Moment 5.85 ± 1.08 D
Volume 559.55 Å 3
Surface Area 486.18 Å 2
HOMO Energy -8.47 ± 0.55 eV
LUMO Energy -0.94 ± eV
Point Group Symmetry C1
Synonyms
  • (3r)-3-(2,3-dihydrobenzofuran-5-yl)-2-[5-(4-methoxyphenyl)-2-pyrimidinyl]-3,4-dihydro-1h-pyrrolo[3,4-b]quinolin-9-one
  • (3r)-3-(2,3-dihydrobenzofuran-5-yl)-2-[5-(4-methoxyphenyl)pyrimidin-2-yl]-3,4-dihydro-1h-pyrrolo[3,4-b]quinolin-9-one
InChIKey MVMQGWXVSBNFLB-MUUNZHRXSA-N
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