![5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione structure](/static/products/5467/5467-63-0.webp)
5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: 5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 5467-63-0) is a chemical compound with molecular formula C20H18N4O5 and molecular weight 394.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-(dimethylamino)-3-nitrophenyl]methylidene]-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione
Also Known As: 5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione, 5-[[4-(dimethylamino)-3-nitrophenyl]methylidene]-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione, 5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione
| Molecular Formula | C20H18N4O5 |
|---|---|
| Molecular Weight | 394.13 g/mol |
| LogP | 2.63562 |
| Topological Polar Surface Area | 112.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 394.12772 |
| Heavy Atoms | 29 |
| Complexity | 1074.2913 |
Chemical Identifiers
| CAS Number | 5467-63-0 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=O)C(=CC3=CC(=C(C=C3)N(C)C)[N+](=O)[O-])C(=O)NC2=O |
Product Overview
5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione (CAS 5467-63-0), with molecular formula C20H18N4O5 and molecular weight 394.13 g/mol. IUPAC: 5-[[4-(dimethylamino)-3-nitrophenyl]methylidene]-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of 5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 2.63562 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 112.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, 5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione has 1 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-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of 5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 5467-63-0.
What is the molecular formula of 5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of 5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione is C20H18N4O5.
What is the molecular weight of 5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of 5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione is 394.13 g/mol.
Where can I buy 5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for 5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-{[4-(Dimethylamino)-3-nitrophenyl]methylidene}-1-(3-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.