Formula |
C35H38N2O5S |
IUPAC Name |
benzyl n-[(1s)-1-benzyl-2-[[(1s)-1-(2-benzylsulfonylethyl)-3-phenyl-propyl]amino]-2-oxo-ethyl]carbamate |
Molecular Mass |
598.752 g·mol−1 |
Heat of Formation |
-650.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.66 ± 1.08 D |
Volume |
742.4 Å 3 |
Surface Area |
505.03 Å 2 |
HOMO Energy |
-9.52 ± 0.55 eV |
LUMO Energy |
2.67 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-[n-[benzyloxycarbonyl]-phenylalaninyl-amino]-5-phenyl-pentane-1-sulfonylmethylbenzene
- n-[(1s)-1-(benzyl)-2-[[(1s)-1-[2-(benzylsulfonyl)ethyl]-3-phenyl-propyl]amino]-2-keto-ethyl]carbamic acid benzyl ester
- n-[(1s)-2-oxo-2-[[(1s)-1-(2-phenylethyl)-3-(phenylmethylsulfonyl)propyl]amino]-1-(phenylmethyl)ethyl]carbamic acid phenylmethyl ester
- phenylmethyl n-[(1s)-2-oxo-2-[[(1s)-1-(2-phenylethyl)-3-(phenylmethylsulfonyl)propyl]amino]-1-(phenylmethyl)ethyl]carbamate
- phenylmethyl n-[(2s)-1-oxo-3-phenyl-1-[[(3s)-1-phenyl-5-(phenylmethylsulfonyl)pentan-3-yl]amino]propan-2-yl]carbamate
- vs2
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InChIKey |
VXIINIMESJGNGI-LQJZCPKCSA-N |
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Links |
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Elements |
H
C
S
O
N
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