![(5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione structure](/static/products/116/1164503-23-4.webp)
(5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione
TL;DR: (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione (CAS 1164503-23-4) is a chemical compound with molecular formula C21H19N3O7 and molecular weight 425.1223 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(1,3-benzodioxol-5-ylmethyliminomethyl)-1-(2,5-dimethoxyphenyl)-6-hydroxypyrimidine-2,4-dione
Also Known As: (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione, (5Z)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione, (5Z)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylidene}-3-(2,5-dimethoxyphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione, (E)-5-(((benzo[d][1,3]dioxol-5-ylmethyl)amino)methylene)-1-(2,5-dimethoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione, 5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione
Technical Specifications
| Molecular Formula | C21H19N3O7 |
| Molecular Weight | 425.1223 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 425.1223 Da |
| Heavy Atoms | 31 |
| Complexity | 755.0 |
| SMILES | COC1=CC(=C(C=C1)OC)N2C(=C(C(=O)NC2=O)C=NCC3=CC4=C(C=C3)OCO4)O |
| InChIKey | ATCZJFYFKFAODE-UHFFFAOYSA-N |
Chemical Property Profile of (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione
Property Insights of (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-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
What is the CAS number of (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione?
The CAS number of (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione is 1164503-23-4.
What is the molecular formula of (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione?
The molecular formula of (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione is C21H19N3O7.
What is the molecular weight of (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione?
The molecular weight of (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione is 425.1223 g/mol.
Where can I buy (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione?
You can request a quote for (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione?
Yes, CoreyChem provides custom synthesis services for (5E)-5-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-(2,5-dimethoxyphenyl)-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.