![1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione structure](/static/products/3139/313953-81-0.webp)
1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione
TL;DR: 1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 313953-81-0) is a chemical compound with molecular formula C19H16ClN3O3 and molecular weight 369.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-5-[N-(4-chlorophenyl)-C-methylcarbonimidoyl]-6-hydroxypyrimidine-2,4-dione
Also Known As: BAS 00666971, AH-034/10980030, (5Z)-1-benzyl-5-[1-(4-chloroanilino)ethylidene]-1,3-diazinane-2,4,6-trione, 1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione, 1-Benzyl-5-[1-(4-chloro-phenylamino)-ethylidene]-pyrimidine-2,4,6-trione
| Molecular Formula | C19H16ClN3O3 |
|---|---|
| Molecular Weight | 369.09 g/mol |
| LogP | 3.0846 |
| Topological Polar Surface Area | 87.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 369.088 |
| Heavy Atoms | 26 |
| Complexity | 1067.9237 |
Chemical Identifiers
| CAS Number | 313953-81-0 |
|---|---|
| SMILES | CC(=NC1=CC=C(C=C1)Cl)C2=C(N(C(=O)NC2=O)CC3=CC=CC=C3)O |
Product Overview
1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione (CAS 313953-81-0), with molecular formula C19H16ClN3O3 and molecular weight 369.09 g/mol. IUPAC: 1-benzyl-5-[N-(4-chlorophenyl)-C-methylcarbonimidoyl]-6-hydroxypyrimidine-2,4-dione.
Chemical Property Profile of 1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione
Property Insights of 1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione
The XLogP value of 3.0846 indicates that 1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione. Following Lipinski's Rule of Five, 1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione has 2 hydrogen bond donor(s) and 4 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-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione?
The CAS number of 1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione is 313953-81-0.
What is the molecular formula of 1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular formula of 1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione is C19H16ClN3O3.
What is the molecular weight of 1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione?
The molecular weight of 1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione is 369.09 g/mol.
Where can I buy 1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione?
You can request a quote for 1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione?
Yes, KEHONG BIO provides custom synthesis services for 1-benzyl-5-[1-(4-chloroanilino)ethylidene]-2,4,6(1H,3H,5H)-pyrimidinetrione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.