![ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate structure](/static/products/577/577985-53-6.png)
ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate
TL;DR: ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate (CAS 577985-53-6) is a chemical compound with molecular formula C14H13N3O6 and molecular weight 319.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate
Also Known As: CC-PMLSC-PW-kmc1048, ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate, ethyl 4-(6-hydroxy-2,4-dioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamido)benzoate, 4-[(6-hydroxy-2,4-diketo-1H-pyrimidine-5-carbonyl)amino]benzoic acid ethyl ester, 4-[[(6-hydroxy-2,4-dioxo-1H-pyrimidin-5-yl)-oxomethyl]amino]benzoic acid ethyl ester
| Molecular Formula | C14H13N3O6 |
|---|---|
| Molecular Weight | 319.08 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.08044 |
| Heavy Atoms | 23 |
| Complexity | 563.0 |
Chemical Identifiers
| CAS Number | 577985-53-6 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(NC(=O)NC2=O)O |
| InChIKey | XWZUFKMEGYKBSH-UHFFFAOYSA-N |
Product Overview
ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate (CAS 577985-53-6), with molecular formula C14H13N3O6 and molecular weight 319.08 g/mol. IUPAC: ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate.
Chemical Property Profile of ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate
Property Insights of ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate. Following Lipinski's Rule of Five, ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate has 4 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 ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate?
The CAS number of ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate is 577985-53-6.
What is the molecular formula of ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate?
The molecular formula of ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate is C14H13N3O6.
What is the molecular weight of ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate?
The molecular weight of ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate is 319.08 g/mol.
Where can I buy ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate?
You can request a quote for ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-[(6-hydroxy-2,4-dioxo-1H-pyrimidine-5-carbonyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.