(4R)-1-(3,3-Dimethylbutanoyl)-4-Hydroxy-N-[3-Methyl-4-(1,3-Thiazol-5-Yl)Benzyl]-L-Prolinamide

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Formula C22H29N3O3S
IUPAC Name (2s,4r)-1-(3,3-dimethylbutanoyl)-4-hydroxy-n-[(3-methyl-4-thiazol-5-yl-phenyl)methyl]pyrrolidine-2-carboxamide
Molecular Mass 415.549 g·mol−1
Heat of Formation -481.7 ± 16.7 kJ·mol−1
Dipole Moment 4.95 ± 1.08 D
Volume 514.8 Å 3
Surface Area 433.55 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy -0.73 ± eV
Point Group Symmetry C1
InChIKey QBAUKFDDQIMOAJ-AEFFLSMTSA-N
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