(2S,3R,4R,5R)-5-{6-[(4-Aminobenzyl)Amino]-9H-Purin-9-Yl}-3,4-Dihydroxy-N-Methyltetrahydro-2-Furancarboxamide
Properties
| Property | Value |
|---|---|
| Formula | C18H21N7O4 |
| IUPAC Name | (2s,3r,4r,5r)-5-[6-[(4-aminophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-n-methyl-tetrahydrofuran-2-carboxamide |
| Molecular Mass | 399.404 g·mol−1 |
| Heat of Formation | -345.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.86 ± 1.08 D |
| Volume | 446.1 Å 3 |
| Surface Area | 396.13 Å 2 |
| HOMO Energy | -8.53 ± 0.55 eV |
| LUMO Energy | -0.15 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | LDYMCRRFCMRFKB-ZUMXRPEOSA-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 |