(3R,4S)-1-[(4-Amino-5H-Pyrrolo[3,2-D]Pyrimidin-7-Yl)Methyl]-4-({[2-(2-Hydroxyethoxy)Ethyl]Sulfanyl}Methyl)-3-Pyrrolidinol
Properties
| Property | Value |
|---|---|
| Formula | C16H25N5O3S |
| IUPAC Name | (1s,3r,4s)-1-[(4-amino-6h-pyrrolo[3,2-d]pyrimidin-5-ium-6-ylium-7-yl)methyl]-4-[2-(2-hydroxyethoxy)ethylsulfanylmethyl]pyrrolidin-3-ol |
| Molecular Mass | 367.466 g·mol−1 |
| Heat of Formation | -292.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.89 ± 1.08 D |
| Volume | 436.63 Å 3 |
| Surface Area | 398.45 Å 2 |
| HOMO Energy | -8.68 ± 0.55 eV |
| LUMO Energy | 2.59 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OXNZLFLPEGTARO-OLZOCXBDSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |