![(5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione structure](/static/products/4284/428486-88-8.webp)
(5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione
TL;DR: (5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione (CAS 428486-88-8) is a chemical compound with molecular formula C22H13N3O8 and molecular weight 447.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione
Also Known As: (5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione, (5E)-1-(1,3-benzodioxol-5-yl)-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione, 1-benzo[1,3]dioxol-5-yl-5-[[5-(3-nitrophenyl)-2-furyl]methylidene]-1,3-diazinane-2,4,6-trione
| Molecular Formula | C22H13N3O8 |
|---|---|
| Molecular Weight | 447.07 g/mol |
| LogP | 3.2499 |
| Topological Polar Surface Area | 141.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 447.07025 |
| Heavy Atoms | 33 |
| Complexity | 1373.4655 |
Chemical Identifiers
| CAS Number | 428486-88-8 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)N3C(=O)/C(=C/C4=CC=C(O4)C5=CC(=CC=C5)[N+](=O)[O-])/C(=O)NC3=O |
Product Overview
(5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione (CAS 428486-88-8), with molecular formula C22H13N3O8 and molecular weight 447.07 g/mol. IUPAC: (5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of (5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione
Property Insights of (5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione
The XLogP value of 3.2499 indicates that (5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.22 Ų indicates high polarity, suggesting (5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione has 1 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-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione?
The CAS number of (5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione is 428486-88-8.
What is the molecular formula of (5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione?
The molecular formula of (5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione is C22H13N3O8.
What is the molecular weight of (5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione?
The molecular weight of (5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione is 447.07 g/mol.
Where can I buy (5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione?
You can request a quote for (5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]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-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for (5E)-1-(1,3-benzodioxol-5-yl)-5-[[5-(3-nitrophenyl)furan-2-yl]methylidene]-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.