![(5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione structure](/static/products/673/673490-37-4.png)
(5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione
TL;DR: (5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione (CAS 673490-37-4) is a chemical compound with molecular formula C22H14Cl2FN3O3 and molecular weight 457.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione
Also Known As: (5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione, (5E)-5-{[1-(3,4-dichlorobenzyl)-1H-pyrrol-2-yl]methylidene}-3-(4-fluorophenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione, (E)-5-((1-(3,4-dichlorobenzyl)-1H-pyrrol-2-yl)methylene)-1-(4-fluorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C22H14Cl2FN3O3 |
|---|---|
| Molecular Weight | 457.04 g/mol |
| LogP | 4.6487 |
| Topological Polar Surface Area | 71.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 457.0396 |
| Heavy Atoms | 31 |
| Complexity | 1235.0531 |
Chemical Identifiers
| CAS Number | 673490-37-4 |
|---|---|
| SMILES | C1=CN(C(=C1)/C=C/2\C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)F)CC4=CC(=C(C=C4)Cl)Cl |
Product Overview
(5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione (CAS 673490-37-4), with molecular formula C22H14Cl2FN3O3 and molecular weight 457.04 g/mol. IUPAC: (5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of (5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione
Property Insights of (5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione
The XLogP value of 4.6487 indicates that (5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.41 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione has 1 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 (5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione?
The CAS number of (5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione is 673490-37-4.
What is the molecular formula of (5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione?
The molecular formula of (5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione is C22H14Cl2FN3O3.
What is the molecular weight of (5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione?
The molecular weight of (5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione is 457.04 g/mol.
Where can I buy (5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione?
You can request a quote for (5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-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)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for (5E)-5-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methylidene]-1-(4-fluorophenyl)-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.