![1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione structure](/static/products/586/586994-46-9.png)
1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione
TL;DR: 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione (CAS 586994-46-9) is a chemical compound with molecular formula C20H20N4O3 and molecular weight 364.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[C-ethyl-N-(pyridin-3-ylmethyl)carbonimidoyl]-6-hydroxy-1-(4-methylphenyl)pyrimidine-2,4-dione
Also Known As: 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione, 5-[1-[(Pyridin-3-ylmethyl)-amino]-prop-(E)-ylidene]-1-p-tolyl-pyrimidine-2,4,6-trione, (5E)-1-(4-methylphenyl)-2,6-dioxo-5-{1-[(pyridinium-3-ylmethyl)amino]propylidene}-1,2,5,6-tetrahydropyrimidin-4-olate, (5E)-1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione, (E)-5-(1-((pyridin-3-ylmethyl)amino)propylidene)-1-(p-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C20H20N4O3 |
|---|---|
| Molecular Weight | 364.15 g/mol |
| LogP | 2.33412 |
| Topological Polar Surface Area | 100.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 364.15353 |
| Heavy Atoms | 27 |
| Complexity | 1080.95 |
Chemical Identifiers
| CAS Number | 586994-46-9 |
|---|---|
| SMILES | CCC(=NCC1=CN=CC=C1)C2=C(N(C(=O)NC2=O)C3=CC=C(C=C3)C)O |
Product Overview
1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione (CAS 586994-46-9), with molecular formula C20H20N4O3 and molecular weight 364.15 g/mol. IUPAC: 5-[C-ethyl-N-(pyridin-3-ylmethyl)carbonimidoyl]-6-hydroxy-1-(4-methylphenyl)pyrimidine-2,4-dione.
Chemical Property Profile of 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione
Property Insights of 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione
The XLogP value of 2.33412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione. The TPSA of 100.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione has 2 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 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione?
The CAS number of 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione is 586994-46-9.
What is the molecular formula of 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione?
The molecular formula of 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione is C20H20N4O3.
What is the molecular weight of 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione?
The molecular weight of 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione is 364.15 g/mol.
Where can I buy 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione?
You can request a quote for 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-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 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.