2-[(Z)-(5-Fluoro-2-Oxo-1,2-Dihydro-3H-Indol-3-Ylidene)Methyl]-5-[(2R)-2-Hydroxy-3-(4-Morpholinyl)Propyl]-3-Methyl-5,6,7,8-Tetrahydropyrrolo[3,2-C]Azepin-4(1H)-One

Molecule SVG Image

Properties Simple | Detailed

Formula C25H29FN4O4
IUPAC Name 2-[(z)-(5-fluoro-2-oxo-indolin-3-ylidene)methyl]-5-[(2r)-2-hydroxy-3-morpholino-propyl]-3-methyl-1,6,7,8-tetrahydropyrrolo[3,2-c]azepin-4-one
Molecular Mass 468.521 g·mol−1
Heat of Formation -685.8 ± 16.7 kJ·mol−1
Dipole Moment 4.85 ± 1.08 D
Volume 544.22 Å 3
Surface Area 455.21 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy -1.39 ± eV
Point Group Symmetry C1
InChIKey MCTXSDCWFQAGFS-UEXNTNOUSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O F