N-(4-{[2-(2,4-Diamino-6-Pteridinyl)Ethyl]Sulfanyl}Benzoyl)Glutamic Acid
Properties
| Property | Value |
|---|---|
| Formula | C20H21N7O5S |
| IUPAC Name | (2r)-2-[[4-[2-(2,4-diaminopteridin-6-yl)ethylsulfanyl]benzoyl]amino]pentanedioic acid |
| Molecular Mass | 471.490 g·mol−1 |
| Heat of Formation | -592.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.88 ± 1.08 D |
| Volume | 523.82 Å 3 |
| Surface Area | 431.87 Å 2 |
| HOMO Energy | -8.74 ± 0.55 eV |
| LUMO Energy | -0.99 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FXGBKUVTNNFJHR-CYBMUJFWSA-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 |