5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione
TL;DR: 5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione (CAS 4878-54-0) is a chemical compound with molecular formula C11H11N3O3 and molecular weight 233.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-methoxyanilino)-1H-pyrimidine-2,4-dione
Also Known As: NCIOpen2_002906, 5-[(4-methoxyphenyl)amino]uracil, 5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione, NCI60_022781, 5-(4-methoxyanilino)-1H-pyrimidine-2,4-dione
| Molecular Formula | C11H11N3O3 |
|---|---|
| Molecular Weight | 233.08 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 79.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.08005 |
| Heavy Atoms | 17 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 4878-54-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC2=CNC(=O)NC2=O |
| InChIKey | REQUYQKTHSNJBA-UHFFFAOYSA-N |
Product Overview
5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione (CAS 4878-54-0), with molecular formula C11H11N3O3 and molecular weight 233.08 g/mol. IUPAC: 5-(4-methoxyanilino)-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione
Property Insights of 5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione. The TPSA of 79.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, 5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione has 3 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 5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione?
The CAS number of 5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione is 4878-54-0.
What is the molecular formula of 5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione?
The molecular formula of 5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione is C11H11N3O3.
What is the molecular weight of 5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione?
The molecular weight of 5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione is 233.08 g/mol.
Where can I buy 5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione?
You can request a quote for 5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-((4-Methoxyphenyl)amino)pyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.