1-(2-Hydroxyethyl)-3-(2-Methyl-2-Butanyl)-5-[4-(2-Methyl-1H-Imidazol-1-Yl)Phenyl]-6,7-Dihydropyrazolo[4,3-E][1,4]Diazepin-8(1H)-One
Properties
| Property | Value |
|---|---|
| Formula | C23H28N6O2 |
| IUPAC Name | 3-(1,1-dimethylpropyl)-1-(2-hydroxyethyl)-5-[4-(2-methylimidazol-1-yl)phenyl]-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one |
| Molecular Mass | 420.507 g·mol−1 |
| Heat of Formation | 31.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.76 ± 1.08 D |
| Volume | 508.52 Å 3 |
| Surface Area | 431.23 Å 2 |
| HOMO Energy | -9.20 ± 0.55 eV |
| LUMO Energy | 1.77 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | FSYSOQAXVZSDSJ-UHFFFAOYSA-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 |