8-Bromo-2-[(4-Methyl-1-Piperazinyl)Methyl][1]Benzofuro[3,2-D]Pyrimidin-4(1H)-One
Properties
Property | Value |
---|---|
Formula | C16H17BrN4O2 |
IUPAC Name | 8-bromo-2-[(4-methylpiperazin-1-yl)methyl]benzofuro[3,2-d]pyrimidine-3,5-diium-4-one |
Molecular Mass | 377.236 g·mol−1 |
Heat of Formation | 16.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.11 ± 1.08 D |
Volume | 380.37 Å 3 |
Surface Area | 341.77 Å 2 |
HOMO Energy | -9.06 ± 0.55 eV |
LUMO Energy | 1.84 ± eV |
Point Group Symmetry | C1 |
InChIKey | OOINHKLROPYETD-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 Br N |