Ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate
TL;DR: Ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate (CAS 501649-38-3) is a chemical compound with molecular formula C11H15IN2O4 and molecular weight 366.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate
Also Known As: ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate
| Molecular Formula | C11H15IN2O4 |
|---|---|
| Molecular Weight | 366.01 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 70.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 366.00766 |
| Heavy Atoms | 18 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 501649-38-3 |
|---|---|
| SMILES | CCOC1=NC(=NC(=C1I)C(=O)OCC)OCC |
| InChIKey | VXSBFYDGEJJQEG-UHFFFAOYSA-N |
Product Overview
Ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate (CAS 501649-38-3), with molecular formula C11H15IN2O4 and molecular weight 366.01 g/mol. IUPAC: ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate.
Chemical Property Profile of Ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate
Property Insights of Ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate. Following Lipinski's Rule of Five, Ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate has 0 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 2,6-diethoxy-5-iodopyrimidine-4-carboxylate?
The CAS number of Ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate is 501649-38-3.
What is the molecular formula of Ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate?
The molecular formula of Ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate is C11H15IN2O4.
What is the molecular weight of Ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate?
The molecular weight of Ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate is 366.01 g/mol.
Where can I buy Ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate?
You can request a quote for Ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2,6-diethoxy-5-iodopyrimidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.