{11-[4-(Benzyloxy)-2-Fluorophenyl]-6-Hydroxy-3,3-Dimethyl-1,1-Dioxido-3,4,5,11-Tetrahydrothiopyrano[3,2-B][1,5]Benzodiazepin-10(2H)-Yl}(6-Methyl-2-Pyridinyl)Methanone
Properties
| Property | Value |
|---|---|
| Formula | C34H32FN3O5S |
| IUPAC Name | [(5s)-5-(4-benzyloxy-2-fluoro-phenyl)-10-hydroxy-2,2-dimethyl-4,4-dioxo-1,3,5,11-tetrahydrothiopyrano[2,3-c][1,5]benzodiazepin-6-yl]-(6-methyl-2-pyridyl)methanone |
| Molecular Mass | 613.698 g·mol−1 |
| Heat of Formation | -621.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 12.44 ± 1.08 D |
| Volume | 702.72 Å 3 |
| Surface Area | 520.4 Å 2 |
| HOMO Energy | -8.46 ± 0.55 eV |
| LUMO Energy | -0.84 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CLEOWFBQYYBWRR-HKBQPEDESA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C F H O N S |