N-[(2R)-1,4-Dioxan-2-Ylmethyl]-N-Methyl-N'-{5-Oxo-3-[1-(4-Piperidinyl)-1H-Pyrazol-4-Yl]-5H-Benzo[4,5]Cyclohepta[1,2-B]Pyridin-7-Yl}Sulfuric Diamide
Properties
| Property | Value |
|---|---|
| Formula | C28H32N6O5S |
| IUPAC Name | 14-[[[(2r)-1,4-dioxan-2-yl]methyl-methyl-sulfamoyl]amino]-2-oxo-5-[1-(4-piperidyl)pyrazol-4-yl]-7-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,9,12,14-heptaene |
| Molecular Mass | 564.656 g·mol−1 |
| Heat of Formation | -344.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.74 ± 1.08 D |
| Volume | 643.51 Å 3 |
| Surface Area | 499.43 Å 2 |
| HOMO Energy | -8.76 ± 0.55 eV |
| LUMO Energy | 1.96 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IVWIPVHBADPMSP-XMMPIXPASA-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 |