3-(5-Methyl-1,2,4-Oxadiazol-3-Yl)-N-(4-{2-[7-(Methylsulfonyl)-1,2,4,5-Tetrahydro-3H-3-Benzazepin-3-Yl]Ethyl}Cyclohexyl)Benzamide
Properties
| Property | Value |
|---|---|
| Formula | C29H36N4O4S |
| IUPAC Name | 3-(5-methyl-1,2,4-oxadiazol-3-yl)-n-[4-[2-(7-methylsulfonyl-1,2,4,5-tetrahydro-3-benzazepin-3-yl)ethyl]cyclohexyl]benzamide |
| Molecular Mass | 536.686 g·mol−1 |
| Heat of Formation | 1621.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 13.66 ± 1.08 D |
| Volume | 633.47 Å 3 |
| Surface Area | 540.58 Å 2 |
| HOMO Energy | -5.59 ± 0.55 eV |
| LUMO Energy | -4.70 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ZHQUFEJLPBTKSM-PGCGBBBBSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |