![(5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione structure](/static/products/586/586987-50-0.png)
(5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione
TL;DR: (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione (CAS 586987-50-0) is a chemical compound with molecular formula C20H21N3O6 and molecular weight 399.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(3,4-dimethoxyphenyl)ethyl]-5-(furan-2-ylmethyliminomethyl)-6-hydroxypyrimidine-2,4-dione
Also Known As: (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione, (5Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-5-{[(furan-2-ylmethyl)amino]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione, (Z)-1-(3,4-dimethoxyphenethyl)-5-(((furan-2-ylmethyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione, 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(2-furylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione, 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione
| Molecular Formula | C20H21N3O6 |
|---|---|
| Molecular Weight | 399.14 g/mol |
| LogP | 1.7142 |
| Topological Polar Surface Area | 119.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 399.14304 |
| Heavy Atoms | 29 |
| Complexity | 1112.2306 |
Chemical Identifiers
| CAS Number | 586987-50-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2C(=C(C(=O)NC2=O)C=NCC3=CC=CO3)O)OC |
Product Overview
(5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione (CAS 586987-50-0), with molecular formula C20H21N3O6 and molecular weight 399.14 g/mol. IUPAC: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-(furan-2-ylmethyliminomethyl)-6-hydroxypyrimidine-2,4-dione.
Chemical Property Profile of (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione
Property Insights of (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione
The XLogP value of 1.7142 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione. The TPSA of 119.05 Ų falls within the moderate polarity range, balancing permeability and solubility for (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione has 2 hydrogen bond donor(s) and 7 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 (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione?
The CAS number of (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione is 586987-50-0.
What is the molecular formula of (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione?
The molecular formula of (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione is C20H21N3O6.
What is the molecular weight of (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione?
The molecular weight of (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione is 399.14 g/mol.
Where can I buy (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione?
You can request a quote for (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)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 (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(furan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.