6-Ethyl-5-{3-[2-Methoxy-5-(4-Pyridinyl)Phenyl]-1-Propyn-1-Yl}-2,4-Pyrimidinediamine
Properties
| Property | Value |
|---|---|
| Formula | C21H21N5O |
| IUPAC Name | 6-ethyl-5-[3-[2-methoxy-5-(4-pyridyl)phenyl]prop-1-ynyl]pyrimidine-2,4-diamine |
| Molecular Mass | 359.424 g·mol−1 |
| Heat of Formation | 326.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.11 ± 1.08 D |
| Volume | 443.2 Å 3 |
| Surface Area | 387.31 Å 2 |
| HOMO Energy | -8.41 ± 0.55 eV |
| LUMO Energy | 2.58 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CZCHMGRCEXJPTP-UHFFFAOYSA-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 |