{(1R)-2-Cyclobutyl-1-[({(1R,2S,5S)-3-[N-({(2S)-3,3-Dimethyl-1-[Methyl(Methylsulfonyl)Amino]-2-Butanyl}Carbamoyl)-3-Methyl-L-Valyl]-6,6-Dimethyl-3-Azabicyclo[3.1.0]Hex-2-Yl}Carbonyl)Amino]Ethyl}Boronic Acid
Properties
| Property | Value |
|---|---|
| Formula | C29H54BN5O7S |
| IUPAC Name | [2-cyclobutyl-1-[[3-[2-[[2,2-dimethyl-1-[[methyl(methylsulfonyl)amino]methyl]propyl]carbamoylamino]-3,3-dimethyl-butanoyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carbonyl]amino]ethyl]boronic acid |
| Molecular Mass | 627.644 g·mol−1 |
| Heat of Formation | -1676.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.28 ± 1.08 D |
| Volume | 806.31 Å 3 |
| Surface Area | 597.47 Å 2 |
| HOMO Energy | -8.98 ± 0.55 eV |
| LUMO Energy | 3.06 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KGZWDDBJGGJYLY-WKOLOUIMSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C B H O N S |