Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate
TL;DR: Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate (CAS 82099-98-7) is a chemical compound with molecular formula C7H9N3O3 and molecular weight 183.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-amino-2-oxo-1H-pyrimidine-5-carboxylate
Also Known As: ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate, ChemDiv2_000268, ethyl cytosine-5-carboxylate, ethyl 6-amino-2-oxo-1H-pyrimidine-5-carboxylate, ethyl 6-amino-2-oxo-1,2-dihydropyrimidine-5-carboxylate
| Molecular Formula | C7H9N3O3 |
|---|---|
| Molecular Weight | 183.06 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 93.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 183.06439 |
| Heavy Atoms | 13 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 82099-98-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=O)N=C1)N |
| InChIKey | GGHDCMZITFQXRE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate (CAS 82099-98-7), with molecular formula C7H9N3O3 and molecular weight 183.06 g/mol. IUPAC: ethyl 6-amino-2-oxo-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate
Property Insights of Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate
The XLogP value of -0.2 indicates that Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 93.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate 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 Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate?
The CAS number of Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate is 82099-98-7.
What is the molecular formula of Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate?
The molecular formula of Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate is C7H9N3O3.
What is the molecular weight of Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate?
The molecular weight of Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate is 183.06 g/mol.
Where can I buy Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate?
You can request a quote for Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-amino-2-hydroxypyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.