TL;DR: [1,2,5]Oxadiazolo[3,4-b]quinoxaline, 6,7-dimethyl-, 1-oxide (CAS 108047-47-8) is a chemical compound with molecular formula C10H8N4O2 and molecular weight 216.06473 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6,7-dimethyl-3-oxido-[1,2,5]oxadiazolo[3,4-b]quinoxalin-3-ium
Also Known As: 6,7-dimethyl-furoxano<3,4-b>quinoxaline, [1,2,5]Oxadiazolo[3,4-b]quinoxaline, 6,7-dimethyl-, 1-oxide, 6,7-Dimethyl-furazano[3,4-b]quinoxaline-1-oxide, 6,7-dimethyl-3-oxido-[1,2,5]oxadiazolo[3,4-b]quinoxalin-3-ium, 6,7-Dimethyl[1,2,5]oxadiazolo[3,4-b]quinoxaline-1-oxide
| Molecular Formula | C10H8N4O2 |
| Molecular Weight | 216.06473 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 77.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 216.06473 Da |
| Heavy Atoms | 16 |
| Complexity | 278.0 |
| SMILES | CC1=CC2=NC3=NO[N+](=C3N=C2C=C1C)[O-] |
| InChIKey | RDHAFPLFAWNBFR-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [1,2,5]Oxadiazolo[3,4-b]quinoxaline, 6,7-dimethyl-, 1-oxide. The TPSA of 77.3 Ų falls within the moderate polarity range, balancing permeability and solubility for [1,2,5]Oxadiazolo[3,4-b]quinoxaline, 6,7-dimethyl-, 1-oxide. Following Lipinski's Rule of Five, [1,2,5]Oxadiazolo[3,4-b]quinoxaline, 6,7-dimethyl-, 1-oxide has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of [1,2,5]Oxadiazolo[3,4-b]quinoxaline, 6,7-dimethyl-, 1-oxide is 108047-47-8.
The molecular formula of [1,2,5]Oxadiazolo[3,4-b]quinoxaline, 6,7-dimethyl-, 1-oxide is C10H8N4O2.
The molecular weight of [1,2,5]Oxadiazolo[3,4-b]quinoxaline, 6,7-dimethyl-, 1-oxide is 216.06473 g/mol.
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