3-(1-Azepanyl)-9-(Dimethylamino)Pyrido[3',2':4,5]Thieno[3,2-D]Pyrimidin-4(3H)-One
Properties
| Property | Value |
|---|---|
| Formula | C17H21N5OS |
| IUPAC Name | 5-(azepan-1-yl)-13-(dimethylamino)-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,9,11-pentaen-6-one |
| Molecular Mass | 343.447 g·mol−1 |
| Heat of Formation | 189.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.94 ± 1.08 D |
| Volume | 400.08 Å 3 |
| Surface Area | 341.48 Å 2 |
| HOMO Energy | -8.37 ± 0.55 eV |
| LUMO Energy | -1.54 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | GYWGXEGOXODOQU-UHFFFAOYSA-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 |