Diethyl (4-{[({[(2S,3S,4R,5R)-5-(2,4-Dioxo-3,4-Dihydro-1(2H)-Pyrimidinyl)-3,4-Dihydroxytetrahydro-2-Furanyl]Carbonyl}Amino)Acetyl]Amino}Benzyl)Phosphonate
Properties
| Property | Value |
|---|---|
| Formula | C22H29N4O10P |
| IUPAC Name | (2s,3s,4r,5r)-n-[2-[4-(diethoxyphosphorylmethyl)anilino]-2-oxo-ethyl]-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-carboxamide |
| Molecular Mass | 540.460 g·mol−1 |
| Heat of Formation | -1945.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.58 ± 1.08 D |
| Volume | 608.25 Å 3 |
| Surface Area | 451.0 Å 2 |
| HOMO Energy | -8.80 ± 0.55 eV |
| LUMO Energy | -0.61 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | AEVBPXDFDKBGLT-YOUFYPILSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C H O N |