(2S)-2-Amino-N-[(2S,3R,4S,5R)-5-[6-(Dimethylamino)-9H-Purin-9-Yl]-4-Hydroxy-2-(Hydroxymethyl)Tetrahydro-3-Furanyl]-3-(4-Methoxyphenyl)Propanamide
Properties
| Property | Value |
|---|---|
| Formula | C22H29N7O5 |
| IUPAC Name | (2r)-2-amino-n-[(2s,3r,4r,5r)-5-[6-(dimethylamino)purine-1,3,7-triium-9-yl]-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl]-3-(4-methoxyphenyl)propanamide |
| Molecular Mass | 471.510 g·mol−1 |
| Heat of Formation | -570.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.68 ± 1.08 D |
| Volume | 547.95 Å 3 |
| Surface Area | 456.43 Å 2 |
| HOMO Energy | -8.63 ± 0.55 eV |
| LUMO Energy | -0.43 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | RXWNCPJZOCPEPQ-KSRBKSDESA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |