5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione
TL;DR: 5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione (CAS 843624-87-3) is a chemical compound with molecular formula C21H21N3O5 and molecular weight 395.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2,5-dimethoxyphenyl)iminomethyl]-1-(3,4-dimethylphenyl)-6-hydroxypyrimidine-2,4-dione
Also Known As: 5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione, (5Z)-5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione, (5Z)-5-{[(2,5-dimethoxyphenyl)amino]methylidene}-3-(3,4-dimethylphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione, (Z)-5-(((2,5-dimethoxyphenyl)amino)methylene)-1-(3,4-dimethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C21H21N3O5 |
|---|---|
| Molecular Weight | 395.15 g/mol |
| LogP | 2.61604 |
| Topological Polar Surface Area | 105.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.14813 |
| Heavy Atoms | 29 |
| Complexity | 1207.9141 |
Chemical Identifiers
| CAS Number | 843624-87-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N2C(=C(C(=O)NC2=O)C=NC3=C(C=CC(=C3)OC)OC)O)C |
Product Overview
5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione (CAS 843624-87-3), with molecular formula C21H21N3O5 and molecular weight 395.15 g/mol. IUPAC: 5-[(2,5-dimethoxyphenyl)iminomethyl]-1-(3,4-dimethylphenyl)-6-hydroxypyrimidine-2,4-dione.
Chemical Property Profile of 5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione
Property Insights of 5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione
The XLogP value of 2.61604 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione. The TPSA of 105.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione has 2 hydrogen bond donor(s) and 6 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 5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione?
The CAS number of 5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione is 843624-87-3.
What is the molecular formula of 5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione?
The molecular formula of 5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione is C21H21N3O5.
What is the molecular weight of 5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione?
The molecular weight of 5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione is 395.15 g/mol.
Where can I buy 5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione?
You can request a quote for 5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-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 5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-[(2,5-dimethoxyanilino)methylidene]-1-(3,4-dimethylphenyl)-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.