![(5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid structure](/static/products/116/1164503-11-0.webp)
(5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid
TL;DR: (5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid (CAS 1164503-11-0) is a chemical compound with molecular formula C21H25N3O5 and molecular weight 399.1794 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[N-(1,3-benzodioxol-5-ylmethyl)-C-ethylcarbonimidoyl]-1-cyclohexyl-6-hydroxypyrimidine-2,4-dione
Also Known As: (5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid, (5E)-5-[1-(1,3-benzodioxol-5-ylmethylamino)propylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione, (5E)-5-{1-[(1,3-benzodioxol-5-ylmethyl)amino]propylidene}-3-cyclohexyl-6-hydroxypyrimidine-2,4(3H,5H)-dione, (E)-5-(1-((benzo[d][1,3]dioxol-5-ylmethyl)amino)propylidene)-1-cyclohexylpyrimidine-2,4,6(1H,3H,5H)-trione, 5-[1-(1,3-benzodioxol-5-ylmethylamino)propylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione
Technical Specifications
| Molecular Formula | C21H25N3O5 |
| Molecular Weight | 399.1794 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.1794 Da |
| Heavy Atoms | 29 |
| Complexity | 713.0 |
| SMILES | CCC(=NCC1=CC2=C(C=C1)OCO2)C3=C(N(C(=O)NC3=O)C4CCCCC4)O |
| InChIKey | PKVBUWHILWJOCJ-UHFFFAOYSA-N |
Chemical Property Profile of (5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid
Property Insights of (5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid. Following Lipinski's Rule of Five, (5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid?
The CAS number of (5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid is 1164503-11-0.
What is the molecular formula of (5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid?
The molecular formula of (5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid is C21H25N3O5.
What is the molecular weight of (5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid?
The molecular weight of (5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid is 399.1794 g/mol.
Where can I buy (5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid?
You can request a quote for (5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid?
Yes, CoreyChem provides custom synthesis services for (5E)-1-cyclohexyl-5-[1-(piperonylamino)propylidene]barbituric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.