1-{[(3R)-3-Methyl-4-({4-[(2S)-1,1,1-Trifluoro-2-Hydroxy-2-Propanyl]Phenyl}Sulfonyl)-1-Piperazinyl]Methyl}Cyclopropanecarboxamide
Properties
| Property | Value |
|---|---|
| Formula | C19H26F3N3O4S |
| IUPAC Name | 1-[[(1s,3r,4s)-3-methyl-4-[4-[(1s)-2,2,2-trifluoro-1-hydroxy-1-methyl-ethyl]phenyl]sulfonyl-piperazin-1-yl]methyl]cyclopropanecarboxamide |
| Molecular Mass | 449.488 g·mol−1 |
| Heat of Formation | -1246.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.01 ± 1.08 D |
| Volume | 502.2 Å 3 |
| Surface Area | 407.25 Å 2 |
| HOMO Energy | -9.41 ± 0.55 eV |
| LUMO Energy | 1.91 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YJFULAYRAKPBCY-DYVFJYSZSA-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 |