TL;DR: 1-Cyclohexyl-3-phenyl-5-propyl-1,3-diazinane-2,4,6-trione (CAS 1045-96-1) is a chemical compound with molecular formula C19H24N2O3 and molecular weight 328.17868 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-cyclohexyl-3-phenyl-5-propyl-1,3-diazinane-2,4,6-trione
Also Known As: 1-Cyclohexyl-3-phenyl-5-propylbarbituric acid, 1-cyclohexyl-3-phenyl-5-propyl-1,3-diazinane-2,4,6-trione, 5-24-09-00128 (Beilstein Handbook Reference), BARBITURIC ACID, 1-CYCLOHEXYL-3-PHENYL-5-PROPYL-, 1-Cyclohexyl-3-phenyl-5-propyl-2,4,6(1H,3H,5H)-pyrimidinetrione
| Molecular Formula | C19H24N2O3 |
| Molecular Weight | 328.17868 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.17868 Da |
| Heavy Atoms | 24 |
| Complexity | 493.0 |
| SMILES | CCCC1C(=O)N(C(=O)N(C1=O)C2=CC=CC=C2)C3CCCCC3 |
| InChIKey | BUTYVUKCJWGMOG-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that 1-Cyclohexyl-3-phenyl-5-propyl-1,3-diazinane-2,4,6-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.7 Ų, 1-Cyclohexyl-3-phenyl-5-propyl-1,3-diazinane-2,4,6-trione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Cyclohexyl-3-phenyl-5-propyl-1,3-diazinane-2,4,6-trione has 0 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 1-Cyclohexyl-3-phenyl-5-propyl-1,3-diazinane-2,4,6-trione is 1045-96-1.
The molecular formula of 1-Cyclohexyl-3-phenyl-5-propyl-1,3-diazinane-2,4,6-trione is C19H24N2O3.
The molecular weight of 1-Cyclohexyl-3-phenyl-5-propyl-1,3-diazinane-2,4,6-trione is 328.17868 g/mol.
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