2-(3-(Piperidin-4-Yloxy)Benzo[B]Thiophen-2-Yl)-5-((1,3,5-Trimethyl-1H-Pyrazol-4-Yl)Methyl)-1,3,4-Oxadiazole
Properties
Property | Value |
---|---|
Formula | C22H25N5O2S |
IUPAC Name | 2-[3-(4-piperidyloxy)benzothiophen-2-yl]-5-[(1,3,5-trimethylpyrazol-4-yl)methyl]-1,3,4-oxadiazole |
Molecular Mass | 423.531 g·mol−1 |
Heat of Formation | 163.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.82 ± 1.08 D |
Volume | 497.52 Å 3 |
Surface Area | 423.55 Å 2 |
HOMO Energy | -8.52 ± 0.55 eV |
LUMO Energy | 1.85 ± eV |
Point Group Symmetry | C1 |
InChIKey | XZORQADPEUSNQJ-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 |