| Formula |
C35H36FN3O9 |
| IUPAC Name |
2-[4-[(2s)-2-acetamido-3-oxo-3-[[(3s)-2-oxo-1-[(4-phenylphenyl)methyl]azepan-3-yl]amino]propyl]-2-methoxycarbonyl-phenyl]-2-fluoro-propanedioic acid |
| Molecular Mass |
661.673 g·mol−1 |
| Heat of Formation |
-1621.0 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.80 ± 1.08 D |
| Volume |
761.09 Å 3 |
| Surface Area |
513.89 Å 2 |
| HOMO Energy |
-8.80 ± 0.55 eV |
| LUMO Energy |
2.20 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-[4-[(2s)-2-acetamido-3-keto-3-[[(3s)-2-keto-1-(4-phenylbenzyl)azepan-3-yl]amino]propyl]-2-carbomethoxy-phenyl]-2-fluoro-malonic acid
- 2-[4-[(2s)-2-acetamido-3-oxo-3-[[(3s)-2-oxo-1-[(4-phenylphenyl)methyl]-3-azepanyl]amino]propyl]-2-methoxycarbonylphenyl]-2-fluoropropanedioic acid
- 2-[4-[(2s)-2-acetamido-3-oxo-3-[[(3s)-2-oxo-1-[(4-phenylphenyl)methyl]azepan-3-yl]amino]propyl]-2-methoxycarbonyl-phenyl]-2-fluoro-propanedioic acid
- 2-[4-[(2s)-2-acetamido-3-oxo-3-[[(3s)-2-oxo-1-[(4-phenylphenyl)methyl]azepan-3-yl]amino]propyl]-2-methoxycarbonylphenyl]-2-fluoropropanedioic acid
- 2-{4-[2-acetylamino-2-(1-biphenyl-4-ylmethyl-2-oxo-azepan-3-ylcarbamoyl)-ethyl]-2-methoxycarbonyl-phenyl}-2-fluoro-malonic acid
- ru90395
|
| InChIKey |
RLLAUERCSKPFGD-VMPREFPWSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
| Elements |
H
C
F
O
N
|
| |
|
