N-{(2S)-3-[(3S)-8',9'-Dihydro-1H,3'H-Spiro[Piperidine-3,7'-Pyrano[3,2-E]Indazol]-1-Yl]-2-Hydroxypropyl}-N-(2-Ethoxyethyl)-2,6-Dimethylbenzenesulfonamide
Properties
| Property | Value |
|---|---|
| Formula | C29H40N4O5S |
| IUPAC Name | n-(2-ethoxyethyl)-n-[(2s)-2-hydroxy-3-[(1'r,7s)-spiro[8,9-dihydropyrano[3,2-e]indazol-3-ium-5a-ylium-7,3'-piperidine]-1'-yl]propyl]-2,6-dimethyl-benzenesulfonamide |
| Molecular Mass | 556.717 g·mol−1 |
| Heat of Formation | -707.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.91 ± 1.08 D |
| Volume | 661.68 Å 3 |
| Surface Area | 428.33 Å 2 |
| HOMO Energy | -8.29 ± 0.55 eV |
| LUMO Energy | -0.70 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZSKFBGIRLVOQAD-MUAVYFROSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |