TL;DR: 5-(Butan-2-yl)-6-hydroxy-3,5-dimethylpyrimidine-2,4(3H,5H)-dione (CAS 4325-43-3) is a chemical compound with molecular formula C10H16N2O3 and molecular weight 212.11609 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-butan-2-yl-1,5-dimethyl-1,3-diazinane-2,4,6-trione
Also Known As: 5-sec-Butyl-1,5-dimethylbarbituric acid, 5-sec-Butyl-1,5-dimethylbarbituricacid, BARBITURIC ACID, 5-sec-BUTYL-1,5-DIMETHYL-, 5-24-09-00158 (Beilstein Handbook Reference), 5-butan-2-yl-1,5-dimethyl-1,3-diazinane-2,4,6-trione
| Molecular Formula | C10H16N2O3 |
| Molecular Weight | 212.11609 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 66.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.11609 Da |
| Heavy Atoms | 15 |
| Complexity | 327.0 |
| SMILES | CCC(C)C1(C(=O)NC(=O)N(C1=O)C)C |
| InChIKey | AYBRRBPPDIRNBY-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Butan-2-yl)-6-hydroxy-3,5-dimethylpyrimidine-2,4(3H,5H)-dione. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(Butan-2-yl)-6-hydroxy-3,5-dimethylpyrimidine-2,4(3H,5H)-dione. Following Lipinski's Rule of Five, 5-(Butan-2-yl)-6-hydroxy-3,5-dimethylpyrimidine-2,4(3H,5H)-dione has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-(Butan-2-yl)-6-hydroxy-3,5-dimethylpyrimidine-2,4(3H,5H)-dione is 4325-43-3.
The molecular formula of 5-(Butan-2-yl)-6-hydroxy-3,5-dimethylpyrimidine-2,4(3H,5H)-dione is C10H16N2O3.
The molecular weight of 5-(Butan-2-yl)-6-hydroxy-3,5-dimethylpyrimidine-2,4(3H,5H)-dione is 212.11609 g/mol.
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