5'-S-[1-(2-{[(2-Amino-4-Oxo-1,4-Dihydro-6-Pteridinyl)Methyl]Amino}Ethyl)-4-Piperidinyl]-5'-Thioadenosine
Properties
| Property | Value |
|---|---|
| Formula | C24H32N12O4S |
| IUPAC Name | 2-amino-6-[[2-[4-[[(2s,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methylsulfanyl]-1-piperidyl]ethylamino]methyl]-1h-pteridin-4-one |
| Molecular Mass | 584.654 g·mol−1 |
| Heat of Formation | -151.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.61 ± 1.08 D |
| Volume | 660.22 Å 3 |
| Surface Area | 530.43 Å 2 |
| HOMO Energy | -8.49 ± 0.55 eV |
| LUMO Energy | 1.96 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KWIHONXLDHOYOZ-YMYXXHFHSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |