2-[(Dichloroacetyl)Amino]Ethyl [(2S,3R)-3-Hydroxy-4-{[(4-Methoxyphenyl)Sulfonyl][(2S)-2-Methylbutyl]Amino}-1-Phenyl-2-Butanyl]Carbamate

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Properties Simple | Detailed

Formula C27H37Cl2N3O7S
IUPAC Name 2-[(2,2-dichloroacetyl)amino]ethyl n-[(1s,2r)-1-benzyl-2-hydroxy-3-[(4-methoxyphenyl)sulfonyl-[(2s)-2-methylbutyl]amino]propyl]carbamate
Molecular Mass 618.570 g·mol−1
Heat of Formation -1275.5 ± 16.7 kJ·mol−1
Dipole Moment 9.16 ± 1.08 D
Volume 699.19 Å 3
Surface Area 531.71 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy -0.73 ± eV
Point Group Symmetry C1
InChIKey JJONTVSMJKRGJO-WDJPJFJCSA-N
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Elements C Cl H O N S