Ethyl 2,4-diaminopyrimidine-5-carboxylate
TL;DR: Ethyl 2,4-diaminopyrimidine-5-carboxylate (CAS 18588-61-9) is a chemical compound with molecular formula C7H10N4O2 and molecular weight 182.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2,4-diaminopyrimidine-5-carboxylate
Also Known As: ethyl 2,4-diaminopyrimidine-5-carboxylate, ETHYL 2,4-DIAMINO-PYRIMIDINE-5-CARBOXYLATE, ethyl 2,4-diamino-5-pyrimidinecarboxylate, 2-(2-Thiazolylazo)-p-cresol, ethyl-2,4-diamino-pyrimidine-5-carboxylate
| Molecular Formula | C7H10N4O2 |
|---|---|
| Molecular Weight | 182.08 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 182.08037 |
| Heavy Atoms | 13 |
| Complexity | 187.0 |
Chemical Identifiers
| CAS Number | 18588-61-9 |
|---|---|
| SMILES | CCOC(=O)C1=CN=C(N=C1N)N |
| InChIKey | MANFWSKJPOXKJZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 2,4-diaminopyrimidine-5-carboxylate (CAS 18588-61-9), with molecular formula C7H10N4O2 and molecular weight 182.08 g/mol. IUPAC: ethyl 2,4-diaminopyrimidine-5-carboxylate.
Chemical Property Profile of Ethyl 2,4-diaminopyrimidine-5-carboxylate
Property Insights of Ethyl 2,4-diaminopyrimidine-5-carboxylate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2,4-diaminopyrimidine-5-carboxylate. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2,4-diaminopyrimidine-5-carboxylate. Following Lipinski's Rule of Five, Ethyl 2,4-diaminopyrimidine-5-carboxylate has 2 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 2,4-diaminopyrimidine-5-carboxylate?
The CAS number of Ethyl 2,4-diaminopyrimidine-5-carboxylate is 18588-61-9.
What is the molecular formula of Ethyl 2,4-diaminopyrimidine-5-carboxylate?
The molecular formula of Ethyl 2,4-diaminopyrimidine-5-carboxylate is C7H10N4O2.
What is the molecular weight of Ethyl 2,4-diaminopyrimidine-5-carboxylate?
The molecular weight of Ethyl 2,4-diaminopyrimidine-5-carboxylate is 182.08 g/mol.
Where can I buy Ethyl 2,4-diaminopyrimidine-5-carboxylate?
You can request a quote for Ethyl 2,4-diaminopyrimidine-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 2,4-diaminopyrimidine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2,4-diaminopyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.