Formula |
C37H48N6O7S |
IUPAC Name |
tert-butyl n-[[4-[[1-[(2s,3r)-3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-1-phenylbutan-2-yl]triazol-4-yl]methylcarbamoyl]phenyl]methyl]carbamate |
Molecular Mass |
720.878 g·mol−1 |
Heat of Formation |
-934.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.57 ± 1.08 D |
Volume |
891.51 Å 3 |
Surface Area |
633.8 Å 2 |
HOMO Energy |
-9.41 ± 0.55 eV |
LUMO Energy |
-0.70 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- tert-butyl 4-[({[1-((1s,2r)-1-benzyl-2-hydroxy-3-{isobutyl[(4-methoxyphenyl)sulfonyl]amino}propyl)-1h-1,2,3-triazol-4-yl]methyl}amino)carbonyl]benzylcarbamate
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InChIKey |
XWYIBXKLXLXYMK-SZAHLOSFSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
S
O
N
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