(4R)-N-[(1S,2R)-2-Hydroxy-2,3-Dihydro-1H-Inden-1-Yl]-3-[(2S,3S)-2-Hydroxy-3-{[S-Methyl-N-(Phenylacetyl)-L-Cysteinyl]Amino}-4-Phenylbutanoyl]-5,5-Dimethyl-1,3-Thiazolidine-4-Carboxamide

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Properties Simple | Detailed

Formula C37H44N4O6S2
IUPAC Name (4r)-n-[(1s,2r)-2-hydroxyindan-1-yl]-3-[(2s,3s)-2-hydroxy-3-[[(2r)-3-methylsulfanyl-2-[(2-phenylacetyl)amino]propanoyl]amino]-4-phenyl-butanoyl]-5,5-dimethyl-thiazolidine-4-carboxamide
Molecular Mass 704.898 g·mol−1
Heat of Formation -948.9 ± 16.7 kJ·mol−1
Dipole Moment 4.57 ± 1.08 D
Volume 846.06 Å 3
Surface Area 582.38 Å 2
HOMO Energy -8.57 ± 0.55 eV
LUMO Energy 2.85 ± eV
Point Group Symmetry C1
InChIKey FCTXMHJXDHGIIN-ACUZRORGSA-N
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