TL;DR: 1-cyclohexyl-5-[1-[3-(diethylamino)propylamino]ethylidene]-1,3-diazinane-2,4,6-trione (CAS 1164491-27-3) is a chemical compound with molecular formula C19H32N4O3 and molecular weight 364.24744 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-cyclohexyl-5-[N-[3-(diethylamino)propyl]-C-methylcarbonimidoyl]-6-hydroxypyrimidine-2,4-dione
Also Known As: 1-cyclohexyl-5-[1-[3-(diethylamino)propylamino]ethylidene]-1,3-diazinane-2,4,6-trione, (5E)-1-cyclohexyl-5-[1-[3-(diethylamino)propylamino]ethylidene]-1,3-diazinane-2,4,6-trione, (5E)-3-cyclohexyl-5-(1-{[3-(diethylamino)propyl]amino}ethylidene)-6-hydroxypyrimidine-2,4(3H,5H)-dione, (E)-1-cyclohexyl-5-(1-((3-(diethylamino)propyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C19H32N4O3 |
| Molecular Weight | 364.24744 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 85.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 364.24744 Da |
| Heavy Atoms | 26 |
| Complexity | 575.0 |
| SMILES | CCN(CC)CCCN=C(C)C1=C(N(C(=O)NC1=O)C2CCCCC2)O |
| InChIKey | YMTYSFCVHNUSCQ-UHFFFAOYSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-cyclohexyl-5-[1-[3-(diethylamino)propylamino]ethylidene]-1,3-diazinane-2,4,6-trione. The TPSA of 85.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-cyclohexyl-5-[1-[3-(diethylamino)propylamino]ethylidene]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 1-cyclohexyl-5-[1-[3-(diethylamino)propylamino]ethylidene]-1,3-diazinane-2,4,6-trione has 2 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-cyclohexyl-5-[1-[3-(diethylamino)propylamino]ethylidene]-1,3-diazinane-2,4,6-trione is 1164491-27-3.
The molecular formula of 1-cyclohexyl-5-[1-[3-(diethylamino)propylamino]ethylidene]-1,3-diazinane-2,4,6-trione is C19H32N4O3.
The molecular weight of 1-cyclohexyl-5-[1-[3-(diethylamino)propylamino]ethylidene]-1,3-diazinane-2,4,6-trione is 364.24744 g/mol.
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