2-[(Trans-4-Aminocyclohexyl)Amino]-4-{[3-(Trifluoromethyl)Phenyl]Amino}Pyrido[4,3-D]Pyrimidin-5(6H)-One
Properties
| Property | Value |
|---|---|
| Formula | C20H21F3N6O |
| IUPAC Name | 2-[(4-aminocyclohexyl)amino]-4-[3-(trifluoromethyl)anilino]pyrido[4,3-d]pyrimidin-5-one |
| Molecular Mass | 418.416 g·mol−1 |
| Heat of Formation | -631.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.82 ± 1.08 D |
| Volume | 464.49 Å 3 |
| Surface Area | 410.6 Å 2 |
| HOMO Energy | -9.05 ± 0.55 eV |
| LUMO Energy | 2.21 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | VWACYUAZKMPNOH-JOCQHMNTSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N O F |