[8-Chloro-6-(2-Fluorophenyl)-4H-Imidazo[1,5-A][1,4]Benzodiazepin-1-Yl]Methyl β-D-Glucopyranosiduronic Acid
Properties
| Property | Value |
|---|---|
| Formula | C24H21ClFN3O7 |
| IUPAC Name | (2s,3s,4r,5s,6r)-6-[[8-chloro-6-(2-fluorophenyl)-4h-imidazo[1,5-a][1,4]benzodiazepin-1-yl]methoxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid |
| Molecular Mass | 517.891 g·mol−1 |
| Heat of Formation | -1029.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.71 ± 1.08 D |
| Volume | 551.64 Å 3 |
| Surface Area | 434.12 Å 2 |
| HOMO Energy | -9.27 ± 0.55 eV |
| LUMO Energy | 2.03 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ICIUMXQTLQXWGL-XALOWKIYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C F H Cl O N |