N-{5-[2-(3,5-Dimethoxyphenyl)Ethyl]-1H-Pyrazol-3-Yl}-4-[(3R,5S)-3,5-Dimethyl-1-Piperazinyl]Benzamide
Properties
| Property | Value |
|---|---|
| Formula | C26H33N5O3 |
| IUPAC Name | n-[5-[2-[3,5-di(methoxy)benzene-4-id-1-yl]ethyl]pyrazol-1-ium-5-ylium-3-yl]-4-[(3r,5s)-3,5-dimethylpiperazin-1-yl]benzamide |
| Molecular Mass | 463.572 g·mol−1 |
| Heat of Formation | -173.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.49 ± 1.08 D |
| Volume | 576.91 Å 3 |
| Surface Area | 480.58 Å 2 |
| HOMO Energy | -8.44 ± 0.55 eV |
| LUMO Energy | 2.80 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | VRQMAABPASPXMW-HDICACEKSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |