(2R)-2-[5-(6-Amino-5-{(1R)-1-[2-(1,3-Dihydro-2H-1,2,3-Triazol-2-Yl)-5-Fluorophenyl]Ethoxy}-3-Pyridinyl)-4-Methyl-1,3-Thiazol-2-Yl]-1,2-Propanediol

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Properties Simple | Detailed

Formula C22H25FN6O3S
IUPAC Name (2r)-2-[5-(6-amino-5-{(1r)-1-[2-(1,3-dihydro-2h-1,2,3-triazol-2-yl)-5-fluorophenyl]ethoxy}-3-pyridinyl)-4-methyl-1,3-thiazol-2-yl]-1,2-propanediol
Molecular Mass 472.536 g·mol−1
Heat of Formation -175.0 ± 16.7 kJ·mol−1
Dipole Moment 4.03 ± 1.08 D
Volume 539.94 Å 3
Surface Area 448.14 Å 2
HOMO Energy -8.34 ± 0.55 eV
LUMO Energy -0.67 ± eV
Point Group Symmetry C1
InChIKey MXETZPYUZKZIMB-MCMMXHMISA-N
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