TL;DR: (5E)-1-cyclohexyl-5-[1-(2-hydroxyethylamino)ethylidene]-1,3-diazinane-2,4,6-trione (CAS 1164505-34-3) is a chemical compound with molecular formula C14H21N3O4 and molecular weight 295.1532 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-cyclohexyl-6-hydroxy-5-[N-(2-hydroxyethyl)-C-methylcarbonimidoyl]pyrimidine-2,4-dione
Also Known As: (5E)-1-cyclohexyl-5-[1-(2-hydroxyethylamino)ethylidene]-1,3-diazinane-2,4,6-trione, 1-cyclohexyl-5-[1-(2-hydroxyethylamino)ethylidene]-1,3-diazinane-2,4,6-trione, (5E)-3-cyclohexyl-6-hydroxy-5-{1-[(2-hydroxyethyl)amino]ethylidene}pyrimidine-2,4(3H,5H)-dione, (E)-1-cyclohexyl-5-(1-((2-hydroxyethyl)amino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C14H21N3O4 |
| Molecular Weight | 295.1532 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.1532 Da |
| Heavy Atoms | 21 |
| Complexity | 492.0 |
| SMILES | CC(=NCCO)C1=C(N(C(=O)NC1=O)C2CCCCC2)O |
| InChIKey | YPGPPUXEQSMVLU-UHFFFAOYSA-N |
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5E)-1-cyclohexyl-5-[1-(2-hydroxyethylamino)ethylidene]-1,3-diazinane-2,4,6-trione. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-1-cyclohexyl-5-[1-(2-hydroxyethylamino)ethylidene]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5E)-1-cyclohexyl-5-[1-(2-hydroxyethylamino)ethylidene]-1,3-diazinane-2,4,6-trione has 3 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 (5E)-1-cyclohexyl-5-[1-(2-hydroxyethylamino)ethylidene]-1,3-diazinane-2,4,6-trione is 1164505-34-3.
The molecular formula of (5E)-1-cyclohexyl-5-[1-(2-hydroxyethylamino)ethylidene]-1,3-diazinane-2,4,6-trione is C14H21N3O4.
The molecular weight of (5E)-1-cyclohexyl-5-[1-(2-hydroxyethylamino)ethylidene]-1,3-diazinane-2,4,6-trione is 295.1532 g/mol.
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