N-(2-{[5-(5-Chloro-2-Thienyl)-1,2-Oxazol-3-Yl]Methoxy}-6-[3-(β-D-Glucopyranosyloxy)Propoxy]Phenyl)-1-Isopropyl-4-Piperidinecarboxamide

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Properties Simple | Detailed

Formula C32H42ClN3O10S
IUPAC Name n-[2-[[5-(5-chloro-2-thienyl)isoxazol-3-yl]methoxy]-6-[3-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxypropoxy]phenyl]-1-isopropyl-piperidine-4-carboxamide
Molecular Mass 696.208 g·mol−1
Heat of Formation -1383.0 ± 16.7 kJ·mol−1
Dipole Moment 3.49 ± 1.08 D
Volume 797.94 Å 3
Surface Area 634.34 Å 2
HOMO Energy -8.63 ± 0.55 eV
LUMO Energy 1.44 ± eV
Point Group Symmetry C1
InChIKey OSTBNMJDSAVEFJ-JFJWUYLVSA-N
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