7-(3-Amino-1-Pyrrolidinyl)-9-Cyclopropyl-6,8-Difluoro[1,2]Thiazolo[5,4-B]Quinoline-3,4(2H,9H)-Dione

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Properties Simple | Detailed

Formula C17H16F2N4O2S
IUPAC Name 7-[(1r,3s)-3-aminopyrrolidin-1-yl]-9-cyclopropyl-6,8-difluoro-5h-isothiazolo[5,4-b]quinoline-3a,4a,5,6,7,8,8a,9a-octaide-3,4-dione
Molecular Mass 378.396 g·mol−1
Heat of Formation 1581.2 ± 16.7 kJ·mol−1
Dipole Moment 6.35 ± 1.08 D
Volume 339.67 Å 3
Surface Area 290.41 Å 2
HOMO Energy -9.43 ± 0.55 eV
LUMO Energy -2.44 ± eV
Point Group Symmetry C1
InChIKey NUOJLJDXSSHQBA-SSDOTTSWSA-N
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