N-(2-Ethoxyethyl)-N-{(2S)-2-Hydroxy-3-[(5R)-2-(4-Quinazolinyl)-2,7-Diazaspiro[4.5]Dec-7-Yl]Propyl}-2,6-Dimethylbenzenesulfonamide

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Properties Simple | Detailed

Formula C31H43N5O4S
IUPAC Name n-(2-ethoxyethyl)-n-[(2s)-2-hydroxy-3-[(2s,5r,9s)-2-quinazolin-4-yl-2,9-diazaspiro[4.5]decan-9-yl]propyl]-2,6-dimethyl-benzenesulfonamide
Molecular Mass 581.769 g·mol−1
Heat of Formation -542.3 ± 16.7 kJ·mol−1
Dipole Moment 6.31 ± 1.08 D
Volume 707.57 Å 3
Surface Area 469.15 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy 2.29 ± eV
Point Group Symmetry C1
InChIKey ABPGHPHYGKUEIO-SUYBVONHSA-N
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