2-((3,5-Dimethyl-1H-Pyrazol-4-Yl)Methyl)-5-(3-(Piperidin-4-Yloxy)Benzo[B]Thiophen-2-Yl)-1,3,4-Oxadiazole
Properties
| Property | Value |
|---|---|
| Formula | C21H23N5O2S |
| IUPAC Name | 2-[(3,5-dimethyl-1h-pyrazol-4-yl)methyl]-5-[3-(4-piperidyloxy)benzothiophen-2-yl]-1,3,4-oxadiazole |
| Molecular Mass | 409.505 g·mol−1 |
| Heat of Formation | 98.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.13 ± 1.08 D |
| Volume | 472.17 Å 3 |
| Surface Area | 368.79 Å 2 |
| HOMO Energy | -8.33 ± 0.55 eV |
| LUMO Energy | 2.16 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BSFSQCSQIOYTCL-UHFFFAOYSA-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 |