2-Amino-1-Ethyl-7-[(3R)-3-Hydroxy-4-Methoxy-3-Methyl-1-Butyn-1-Yl]-N-Methyl-4-Oxo-1,4-Dihydro-1,8-Naphthyridine-3-Carboxamide

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Properties Simple | Detailed

Formula C18H22N4O4
IUPAC Name 2-amino-1-ethyl-7-[(3r)-3-hydroxy-4-methoxy-3-methyl-but-1-ynyl]-n-methyl-4-oxo-1,8-naphthyridin-1-ium-3-ide-3-carboxamide
Molecular Mass 358.392 g·mol−1
Heat of Formation -327.2 ± 16.7 kJ·mol−1
Dipole Moment 6.52 ± 1.08 D
Volume 428.07 Å 3
Surface Area 387.54 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy -1.02 ± eV
Point Group Symmetry C1
InChIKey PFMPOBVAYMTUOX-GOSISDBHSA-N
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