2-[4-[4-(4-Amino-5-Oxo-7,8-Dihydropyrimido[5,4-F][1,4]Oxazepin-6-Yl)Phenyl]Cyclohexyl]Acetic Acid
Properties
| Property | Value |
|---|---|
| Formula | C21H24N4O4 |
| IUPAC Name | 2-[4-[4-(4-amino-5-oxo-7,8-dihydropyrimido[5,4-f][1,4]oxazepin-6-yl)phenyl]cyclohexyl]acetic acid |
| Molecular Mass | 396.440 g·mol−1 |
| Heat of Formation | -562.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.13 ± 1.08 D |
| Volume | 456.45 Å 3 |
| Surface Area | 393.98 Å 2 |
| HOMO Energy | -9.02 ± 0.55 eV |
| LUMO Energy | 2.31 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | GEVVQZHMFVFGLN-HDJSIYSDSA-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 |