(1S)-1-[2-(Difluoromethyl)-4-Pyridinyl]-4-Fluoro-1-[3-(5-Pyrimidinyl)Phenyl]-1H-Isoindol-3-Amine
Properties
| Property | Value |
|---|---|
| Formula | C24H16F3N5 |
| IUPAC Name | (3s)-3-[2-(difluoromethyl)-4-pyridyl]-7-fluoro-3-(3-pyrimidin-5-ylphenyl)isoindol-1-amine |
| Molecular Mass | 431.413 g·mol−1 |
| Heat of Formation | 33.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.04 ± 1.08 D |
| Volume | 473.91 Å 3 |
| Surface Area | 402.92 Å 2 |
| HOMO Energy | -9.54 ± 0.55 eV |
| LUMO Energy | 1.91 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | MRXBCEQZNKUUIP-DEOSSOPVSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N F |