N-{3-[5-Hydroxy-8-(3-Methylbutyl)-7-Oxo-7,8-Dihydroimidazo[1,2-A]Pyrimidin-6-Yl]-1,1-Dioxido-2H-1,2,4-Benzothiadiazin-7-Yl}Methanesulfonamide
Properties
Property | Value |
---|---|
Formula | C19H22N6O6S2 |
IUPAC Name | n-[3-(5-hydroxy-8-isopentyl-7-oxo-imidazo[1,2-a]pyrimidin-6-yl)-1,1-dioxo-4h-1λ6,2,4-benzothiadiazin-7-yl]methanesulfonamide |
Molecular Mass | 494.545 g·mol−1 |
Heat of Formation | 2728.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.30 ± 1.08 D |
Volume | 555.47 Å 3 |
Surface Area | 430.31 Å 2 |
HOMO Energy | -9.12 ± 0.55 eV |
LUMO Energy | -2.70 ± eV |
Point Group Symmetry | C1 |
InChIKey | HJSHQVOBZCLIRI-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | C S O N |