![(5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione structure](/static/products/577/577986-80-2.png)
(5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione
TL;DR: (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione (CAS 577986-80-2) is a chemical compound with molecular formula C22H30N4O6 and molecular weight 446.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-(3-morpholin-4-ylpropyliminomethyl)pyrimidine-2,4-dione
Also Known As: (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione, (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione, (E)-1-(3,4-dimethoxyphenethyl)-5-(((3-morpholinopropyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione, 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione
| Molecular Formula | C22H30N4O6 |
|---|---|
| Molecular Weight | 446.22 g/mol |
| LogP | 0.6433 |
| Topological Polar Surface Area | 118.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 446.21652 |
| Heavy Atoms | 32 |
| Complexity | 1039.6921 |
Chemical Identifiers
| CAS Number | 577986-80-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2C(=C(C(=O)NC2=O)C=NCCCN3CCOCC3)O)OC |
Product Overview
(5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione (CAS 577986-80-2), with molecular formula C22H30N4O6 and molecular weight 446.22 g/mol. IUPAC: 1-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-(3-morpholin-4-ylpropyliminomethyl)pyrimidine-2,4-dione.
Chemical Property Profile of (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione
Property Insights of (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione
The XLogP value of 0.6433 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione. The TPSA of 118.38 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione has 2 hydrogen bond donor(s) and 8 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 (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione?
The CAS number of (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione is 577986-80-2.
What is the molecular formula of (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione?
The molecular formula of (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione is C22H30N4O6.
What is the molecular weight of (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione?
The molecular weight of (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione is 446.22 g/mol.
Where can I buy (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione?
You can request a quote for (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)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 (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for (5E)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.