N-[(2S,3R)-4-{[6-(2,2-Dimethylpropyl)-2,2-Dimethyl-3,4-Dihydro-2H-Thieno[2,3-B]Pyran-4-Yl]Amino}-3-Hydroxy-1-Phenyl-2-Butanyl]Acetamide

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Properties Simple | Detailed

Formula C26H38N2O3S
IUPAC Name n-[(1s,2r)-1-benzyl-3-[[(4s)-6-(2,2-dimethylpropyl)-2,2-dimethyl-3,4-dihydrothieno[2,3-b]pyran-4-yl]amino]-2-hydroxy-propyl]acetamide
Molecular Mass 458.657 g·mol−1
Heat of Formation -569.2 ± 16.7 kJ·mol−1
Dipole Moment 7.11 ± 1.08 D
Volume 595.59 Å 3
Surface Area 490.25 Å 2
HOMO Energy -8.30 ± 0.55 eV
LUMO Energy 3.02 ± eV
Point Group Symmetry C1
InChIKey YLIBYDKWVPKMKX-RJGXRXQPSA-N
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