TL;DR: 1,3-Dimethyl-4-((5-methylfuran-2-yl)hydroxymethyl)uracil (CAS 134924-78-0) is a chemical compound with molecular formula C12H14N2O4 and molecular weight 250.09535 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[hydroxy-(5-methylfuran-2-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione
Also Known As: Furylpyrimidinone, 1,3-Dimethyl-4-((5-methylfuran-2-yl)hydroxymethyl)uracil, 1,3-Dimethyl-5-(alpha-hydroxy-5-methylfurfuryl)uracil, 1,3-Dimethyl-5-((5-methylfuran-2-yl)hydroxymethyl)uracil, 2,4(1H,3H)-Pyrimidinedione, 5-(hydroxy(5-methyl-2-furanyl)methyl)-1,3-dimethyl-
| Molecular Formula | C12H14N2O4 |
| Molecular Weight | 250.09535 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 74.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.09535 Da |
| Heavy Atoms | 18 |
| Complexity | 407.0 |
| SMILES | CC1=CC=C(O1)C(C2=CN(C(=O)N(C2=O)C)C)O |
| InChIKey | IXUUJAZOXKULBC-UHFFFAOYSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dimethyl-4-((5-methylfuran-2-yl)hydroxymethyl)uracil. The TPSA of 74.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dimethyl-4-((5-methylfuran-2-yl)hydroxymethyl)uracil. Following Lipinski's Rule of Five, 1,3-Dimethyl-4-((5-methylfuran-2-yl)hydroxymethyl)uracil has 1 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 1,3-Dimethyl-4-((5-methylfuran-2-yl)hydroxymethyl)uracil is 134924-78-0.
The molecular formula of 1,3-Dimethyl-4-((5-methylfuran-2-yl)hydroxymethyl)uracil is C12H14N2O4.
The molecular weight of 1,3-Dimethyl-4-((5-methylfuran-2-yl)hydroxymethyl)uracil is 250.09535 g/mol.
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