![5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione structure](/static/products/4778/477856-90-9.webp)
5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione
TL;DR: 5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione (CAS 477856-90-9) is a chemical compound with molecular formula C18H22N2O3 and molecular weight 314.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione
Also Known As: 5-[(4-heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione, 5-[(4-heptylphenyl)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione, 11P-139, 5-[(4-heptylphenyl)methylene]hexahydropyrimidine-2,4,6-trione, 5-(4-Heptylphenyl)methylene-2,4,6(1H,3H,5H)-pyrimidinetrione
| Molecular Formula | C18H22N2O3 |
|---|---|
| Molecular Weight | 314.16 g/mol |
| LogP | 2.9489 |
| Topological Polar Surface Area | 75.27 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 314.16306 |
| Heavy Atoms | 23 |
| Complexity | 595.6588 |
Chemical Identifiers
| CAS Number | 477856-90-9 |
|---|---|
| SMILES | CCCCCCCC1=CC=C(C=C1)C=C2C(=O)NC(=O)NC2=O |
Product Overview
5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione (CAS 477856-90-9), with molecular formula C18H22N2O3 and molecular weight 314.16 g/mol. IUPAC: 5-[(4-heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione
Property Insights of 5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione
The XLogP value of 2.9489 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione. The TPSA of 75.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione?
The CAS number of 5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione is 477856-90-9.
What is the molecular formula of 5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione?
The molecular formula of 5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione is C18H22N2O3.
What is the molecular weight of 5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione?
The molecular weight of 5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione is 314.16 g/mol.
Where can I buy 5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione?
You can request a quote for 5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(4-Heptylphenyl)methylidene]-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.