(3S)-3-(4-{(2S)-3-Methyl-2-[(6-Quinolinylmethyl)Amino]-2-Butanyl}-1H-1,2,3-Triazol-1-Yl)-2-Heptanone
Properties
| Property | Value |
|---|---|
| Formula | C24H33N5O |
| IUPAC Name | (3s)-3-[4-[(2s)-3-methyl-2-(quinolin-6-ylmethylamino)butan-2-yl]triazol-1-yl]heptan-2-one |
| Molecular Mass | 407.552 g·mol−1 |
| Heat of Formation | 113.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.66 ± 1.08 D |
| Volume | 533.94 Å 3 |
| Surface Area | 454.19 Å 2 |
| HOMO Energy | -9.05 ± 0.55 eV |
| LUMO Energy | 2.24 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | XHOTUPQHXLRCJV-UPVQGACJSA-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 |