2-{Ethyl[(5-{[6-Methyl-3-(1H-Pyrazol-4-Yl)Imidazo[1,2-A]Pyrazin-8-Yl]Amino}-1,2-Thiazol-3-Yl)Methyl]Amino}-2-Methyl-1-Propanol
Properties
Property | Value |
---|---|
Formula | C20H26N8OS |
IUPAC Name | 2-[ethyl-[[5-[(6-methyl-3-pyrazol-1-ium-2-id-4-yl-5h-imidazo[1,2-a]pyrazine-1,7-diium-3,5-diid-8-yl)amino]isothiazol-3-yl]methyl]amino]-2-methyl-propan-1-ol |
Molecular Mass | 426.538 g·mol−1 |
Heat of Formation | 374.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.08 ± 1.08 D |
Volume | 514.0 Å 3 |
Surface Area | 417.51 Å 2 |
HOMO Energy | -8.48 ± 0.55 eV |
LUMO Energy | 2.13 ± eV |
Point Group Symmetry | C1 |
InChIKey | RHGZQGXELRMGES-UHFFFAOYSA-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 |