[5-Amino-1-(2-Methylphenyl)-1H-Pyrazol-4-Yl]{3-[1-(Methylsulfonyl)-4-Piperidinyl]Phenyl}Methanone
Properties
| Property | Value |
|---|---|
| Formula | C23H26N4O3S |
| IUPAC Name | [5-amino-1-(o-tolyl)pyrazol-4-yl]-[3-(1-methylsulfonyl-4-piperidyl)phenyl]methanone |
| Molecular Mass | 438.543 g·mol−1 |
| Heat of Formation | -165.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.22 ± 1.08 D |
| Volume | 508.73 Å 3 |
| Surface Area | 437.29 Å 2 |
| HOMO Energy | -8.95 ± 0.55 eV |
| LUMO Energy | -0.80 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | KOCQZKPUMDARNV-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 |