N-(2-Methyl-2-Propanyl)-3-{[5-Methyl-2-({4-[2-(1H-Pyrrol-1-Yl)Ethoxy]Phenyl}Amino)-4-Pyrimidinyl]Amino}Benzenesulfonamide
Properties
| Property | Value |
|---|---|
| Formula | C27H32N6O3S |
| IUPAC Name | n-tert-butyl-3-[[5-methyl-2-[4-(2-pyrrol-1-ylethoxy)anilino]pyrimidin-4-yl]amino]benzenesulfonamide |
| Molecular Mass | 520.646 g·mol−1 |
| Heat of Formation | -93.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.37 ± 1.08 D |
| Volume | 618.45 Å 3 |
| Surface Area | 540.27 Å 2 |
| HOMO Energy | -8.44 ± 0.55 eV |
| LUMO Energy | -0.84 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PDGYCXUDHRCGRT-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |