TL;DR: 1-(2-Furylmethyl)-7-methylpyrido[3,4-d]pyridazine-4,5(3H,6H)-dione (CAS 160033-05-6) is a chemical compound with molecular formula C13H11N3O3 and molecular weight 257.08005 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(furan-2-ylmethyl)-7-methyl-3,6-dihydropyrido[3,4-d]pyridazine-4,5-dione
Also Known As: ZERO/005459, 1-(2-Furylmethyl)-7-methylpyrido[3,4-d]pyridazine-4,5(3H,6H)-dione, 1-(furan-2-ylmethyl)-7-methylpyrido[3,4-d]pyridazine-4,5(3H,6H)-dione, 1-(furan-2-ylmethyl)-7-methyl-3,6-dihydropyrido[3,4-d]pyridazine-4,5-dione, 1-(2-furylmethyl)-7-methylpyridino[3,4-d]pyridazine-4,5-diol
| Molecular Formula | C13H11N3O3 |
| Molecular Weight | 257.08005 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 83.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.08005 Da |
| Heavy Atoms | 19 |
| Complexity | 545.0 |
| SMILES | CC1=CC2=C(C(=O)N1)C(=O)NN=C2CC3=CC=CO3 |
| InChIKey | CNZVMERXOUPVOG-UHFFFAOYSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Furylmethyl)-7-methylpyrido[3,4-d]pyridazine-4,5(3H,6H)-dione. The TPSA of 83.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Furylmethyl)-7-methylpyrido[3,4-d]pyridazine-4,5(3H,6H)-dione. Following Lipinski's Rule of Five, 1-(2-Furylmethyl)-7-methylpyrido[3,4-d]pyridazine-4,5(3H,6H)-dione has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(2-Furylmethyl)-7-methylpyrido[3,4-d]pyridazine-4,5(3H,6H)-dione is 160033-05-6.
The molecular formula of 1-(2-Furylmethyl)-7-methylpyrido[3,4-d]pyridazine-4,5(3H,6H)-dione is C13H11N3O3.
The molecular weight of 1-(2-Furylmethyl)-7-methylpyrido[3,4-d]pyridazine-4,5(3H,6H)-dione is 257.08005 g/mol.
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