5-Methyl-3-[4-(4-{5-[(4S)-2-Oxohexahydro-1H-Thieno[3,4-D]Imidazol-4-Yl]Pentyl}-1H-1,2,3-Triazol-1-Yl)Butyl]-1,3-Benzoxazol-2(3H)-One
Properties
| Property | Value |
|---|---|
| Formula | C24H32N6O3S |
| IUPAC Name | 3-[4-[4-[5-[(3as,4s,6ar)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentyl]triazol-1-yl]butyl]-5-methyl-1,3-benzoxazol-2-one |
| Molecular Mass | 484.614 g·mol−1 |
| Heat of Formation | -240.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.11 ± 1.08 D |
| Volume | 583.3 Å 3 |
| Surface Area | 518.86 Å 2 |
| HOMO Energy | -8.93 ± 0.55 eV |
| LUMO Energy | 2.52 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | LIWDYWLHGFRYPL-NYVOZVTQSA-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 |