N-{(2S,3S,5R)-6-{[(2S)-1-(Benzylamino)-3-Methyl-1-Oxo-2-Butanyl]Amino}-1-[(3,5-Difluorobenzyl)Oxy]-3-Hydroxy-5-Methyl-6-Oxo-2-Hexanyl}-5-[Methyl(Methylsulfonyl)Amino]-N'-[(1R)-1-Phenylethyl]Isophthalamide
Properties
| Property | Value |
|---|---|
| Formula | C44H53F2N5O8S |
| IUPAC Name | n1-[(1s,2s,4r)-5-[[(1s)-1-(benzylcarbamoyl)-2-methyl-propyl]amino]-1-[(3,5-difluorophenyl)methoxymethyl]-2-hydroxy-4-methyl-5-oxo-pentyl]-5-[methyl(methylsulfonyl)amino]-n3-[(1r)-1-phenylethyl]benzene-1,3-dicarboxamide |
| Molecular Mass | 849.982 g·mol−1 |
| Heat of Formation | -1697.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.90 ± 1.08 D |
| Volume | 1002.2 Å 3 |
| Surface Area | 663.28 Å 2 |
| HOMO Energy | -9.08 ± 0.55 eV |
| LUMO Energy | -0.98 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SQCCLROLILAOBD-MLLWAOEYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C F H O N S |