![(5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione structure](/static/products/577/577981-53-4.png)
(5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione
TL;DR: (5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione (CAS 577981-53-4) is a chemical compound with molecular formula C17H13ClN4O3 and molecular weight 356.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3-aminophenyl)iminomethyl]-1-(4-chlorophenyl)-6-hydroxypyrimidine-2,4-dione
Also Known As: (5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione, 5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione, (5E)-5-{[(3-aminophenyl)amino]methylidene}-3-(4-chlorophenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione, (E)-5-(((3-aminophenyl)amino)methylene)-1-(4-chlorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C17H13ClN4O3 |
|---|---|
| Molecular Weight | 356.07 g/mol |
| LogP | 2.2176 |
| Topological Polar Surface Area | 113.47 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 356.06763 |
| Heavy Atoms | 25 |
| Complexity | 1068.4865 |
Chemical Identifiers
| CAS Number | 577981-53-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)N=CC2=C(N(C(=O)NC2=O)C3=CC=C(C=C3)Cl)O)N |
Product Overview
(5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione (CAS 577981-53-4), with molecular formula C17H13ClN4O3 and molecular weight 356.07 g/mol. IUPAC: 5-[(3-aminophenyl)iminomethyl]-1-(4-chlorophenyl)-6-hydroxypyrimidine-2,4-dione.
Chemical Property Profile of (5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione
Property Insights of (5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione
The XLogP value of 2.2176 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione. The TPSA of 113.47 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione has 3 hydrogen bond donor(s) and 5 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-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione?
The CAS number of (5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione is 577981-53-4.
What is the molecular formula of (5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione?
The molecular formula of (5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione is C17H13ClN4O3.
What is the molecular weight of (5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione?
The molecular weight of (5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione is 356.07 g/mol.
Where can I buy (5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione?
You can request a quote for (5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-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-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for (5E)-5-[(3-aminoanilino)methylidene]-1-(4-chlorophenyl)-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.