N-Benzyl-2-(2,6-Dimethylphenoxy)-N-{[(3R,4R)-4-{[Isobutyl(Phenylsulfonyl)Amino]Methyl}-3-Pyrrolidinyl]Methyl}Acetamide

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Properties Simple | Detailed

Formula C33H43N3O4S
IUPAC Name n-[[(3r,4r)-4-[[benzenesulfonyl(isobutyl)amino]methyl]pyrrolidin-3-yl]methyl]-n-benzyl-2-(2,6-dimethylphenoxy)acetamide
Molecular Mass 577.777 g·mol−1
Heat of Formation -513.2 ± 16.7 kJ·mol−1
Dipole Moment 1.92 ± 1.08 D
Volume 727.75 Å 3
Surface Area 532.64 Å 2
HOMO Energy -9.04 ± 0.55 eV
LUMO Energy 2.46 ± eV
Point Group Symmetry C1
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InChIKey MQRMHPRUUKDEKO-LOYHVIPDSA-N
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