1-Ethyl-3-(4-{4-[(3S)-3-Methyl-4-Morpholinyl]-6,6-Dioxido-7,8-Dihydro-5H-Thiopyrano[4,3-D]Pyrimidin-2-Yl}Phenyl)Urea
Properties
| Property | Value |
|---|---|
| Formula | C21H27N5O4S |
| IUPAC Name | 1-ethyl-3-[4-[4-[(3s)-3-methylmorpholin-4-yl]-6,6-dioxo-7,8-dihydro-5h-thiopyrano[4,3-d]pyrimidin-2-yl]phenyl]urea |
| Molecular Mass | 445.535 g·mol−1 |
| Heat of Formation | -491.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.44 ± 1.08 D |
| Volume | 509.87 Å 3 |
| Surface Area | 437.32 Å 2 |
| HOMO Energy | -8.86 ± 0.55 eV |
| LUMO Energy | -1.00 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NLFYWTSGSCFECR-AWEZNQCLSA-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 |