2-[4-[(2S,3S,4R,5R)-5-(6-Aminopurine-1,3,7-Triium-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Carbonyl]Piperazin-1-Yl]-N-(1-Oxoisoindolin-4-Yl)Acetamide
Properties
| Property | Value |
|---|---|
| Formula | C24H29N9O6 |
| IUPAC Name | 2-[4-[(2s,3s,4r,5r)-5-(6-aminopurine-1,3,7-triium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-carbonyl]piperazin-1-yl]-n-(1-oxoisoindolin-4-yl)acetamide |
| Molecular Mass | 539.544 g·mol−1 |
| Heat of Formation | -609.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.26 ± 1.08 D |
| Volume | 592.9 Å 3 |
| Surface Area | 491.14 Å 2 |
| HOMO Energy | -9.08 ± 0.55 eV |
| LUMO Energy | 2.42 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XIJLRJYURLKKPZ-UAKAABGRSA-O |
| QR Code | Generate QR Code |
| Links | |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |