Formula |
C35H54N6O8 |
IUPAC Name |
isobutyl n-[(1s)-2-[[(1s)-1-[[(1s)-1-[2-[[2-[[(1s)-2-amino-2-oxo-1-phenyl-ethyl]amino]-2-oxo-ethyl]amino]-2-oxo-acetyl]butyl]carbamoyl]-3-methyl-butyl]amino]-1-cyclohexyl-2-oxo-ethyl]carbamate |
Molecular Mass |
686.839 g·mol−1 |
Heat of Formation |
-1644.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.28 ± 1.08 D |
Volume |
868.59 Å 3 |
Surface Area |
706.03 Å 2 |
HOMO Energy |
-9.49 ± 0.55 eV |
LUMO Energy |
2.83 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- ({1-[1-carbamoyl-phenyl-methyl)-carbamoyl]-methyl}-aminooxalyl)-butylcarbamoyl)-3-methyl-butylcarbamoyl)-cyclohexyl-methyl)-carbamic acid isobutyl ester
- 2-methylpropyl n-[(1s)-2-[[(2s)-1-[[(3s)-1-[[2-[[(1s)-2-amino-2-oxo-1-phenyl-ethyl]amino]-2-oxo-ethyl]amino]-1,2-dioxo-hexan-3-yl]amino]-4-methyl-1-oxo-pentan-2-yl]amino]-1-cyclohexyl-2-oxo-ethyl]carbamate
- 2-methylpropyl n-[(1s)-2-[[(2s)-1-[[(3s)-1-[[2-[[(1s)-2-amino-2-oxo-1-phenylethyl]amino]-2-oxoethyl]amino]-1,2-dioxohexan-3-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-cyclohexyl-2-oxoethyl]carbamate
- n-[(1s)-2-[[(1s)-1-[[(1s)-1-[2-[[2-[[(1s)-2-amino-2-keto-1-phenyl-ethyl]amino]-2-keto-ethyl]amino]-2-keto-acetyl]butyl]carbamoyl]-3-methyl-butyl]amino]-1-cyclohexyl-2-keto-ethyl]carbamic acid isobutyl ester
|
InChIKey |
CSOCTFLGSKTNFD-DZXSPZCNSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
O
N
|
|
|