[1-({5-[6-(Dimethylamino)-9H-Purin-9-Yl]-4-Hydroxy-2-(Hydroxymethyl)Tetrahydro-3-Furanyl}Amino)-3-(4-Methoxyphenyl)-1-Oxo-2-Propanyl]Phosphoramidic Acid
Properties
| Property | Value |
|---|---|
| Formula | C22H30N7O8P |
| IUPAC Name | [[(1r)-2-[[(2r,3r,4r,5r)-5-[6-(dimethylamino)purin-9-yl]-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl]amino]-1-[(4-methoxyphenyl)methyl]-2-oxo-ethyl]amino]phosphonic acid |
| Molecular Mass | 551.489 g·mol−1 |
| Heat of Formation | -1395.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.62 ± 1.08 D |
| Volume | 612.1 Å 3 |
| Surface Area | 490.93 Å 2 |
| HOMO Energy | -8.67 ± 0.55 eV |
| LUMO Energy | -0.58 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FHDMBNGCWMYGNF-NVWDDTSBSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |