2-{4-[(2R)-4-[(6-Amino-3-Pyridinyl)Sulfonyl]-2-(1-Propyn-1-Yl)-1-Piperazinyl]Phenyl}-1,1,1,3,3,3-Hexafluoro-2-Propanol
Properties
| Property | Value |
|---|---|
| Formula | C21H20F6N4O3S |
| IUPAC Name | 2-[4-[(1s,2r,4s)-4-[(6-amino-3-pyridyl)sulfonyl]-2-prop-1-ynyl-piperazin-1-yl]phenyl]-1,1,1,3,3,3-hexafluoro-propan-2-ol |
| Molecular Mass | 522.464 g·mol−1 |
| Heat of Formation | -1367.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.12 ± 1.08 D |
| Volume | 537.39 Å 3 |
| Surface Area | 449.89 Å 2 |
| HOMO Energy | -8.89 ± 0.55 eV |
| LUMO Energy | -1.04 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | SIFKNECWLVONIH-MRXNPFEDSA-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 |