(2R)-1,1,1-Trifluoro-2-{4-[(2S)-2-{[(3S)-3-Methyl-4-Morpholinyl]Methyl}-4-(2-Thienylsulfonyl)-1-Piperazinyl]Phenyl}-2-Propanol
Properties
| Property | Value |
|---|---|
| Formula | C23H30F3N3O4S2 |
| IUPAC Name | (2r)-1,1,1-trifluoro-2-[4-[(1r,2s,4r)-2-[[(3s,4r)-3-methylmorpholin-4-yl]methyl]-4-(2-thienylsulfonyl)piperazin-1-yl]phenyl]propan-2-ol |
| Molecular Mass | 533.627 g·mol−1 |
| Heat of Formation | -1146.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.92 ± 1.08 D |
| Volume | 597.79 Å 3 |
| Surface Area | 442.47 Å 2 |
| HOMO Energy | -8.57 ± 0.55 eV |
| LUMO Energy | 1.79 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OJTJLEFGCNYTBQ-RBDMOPTHSA-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 |