N-(4-{2-[(6S)-2-Amino-4-Oxo-1,4,5,6,7,8-Hexahydropyrido[2,3-D]Pyrimidin-6-Yl]Ethyl}Benzoyl)-D-Glutamic Acid
Properties
| Property | Value |
|---|---|
| Formula | C21H25N5O6 |
| IUPAC Name | (2r)-2-[[4-[2-[(6s)-2-amino-4-oxo-5,6,7,8-tetrahydropyrido[2,3-d]pyrimidin-1-ium-3-id-6-yl]ethyl]benzoyl]amino]pentanedioic acid |
| Molecular Mass | 443.453 g·mol−1 |
| Heat of Formation | -949.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.84 ± 1.08 D |
| Volume | 512.11 Å 3 |
| Surface Area | 454.51 Å 2 |
| HOMO Energy | -8.99 ± 0.55 eV |
| LUMO Energy | 2.42 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZUQBAQVRAURMCL-SWLSCSKDSA-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 |