ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate
TL;DR: ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate (CAS 69722-29-8) is a chemical compound with molecular formula C11H12N4O2 and molecular weight 232.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-amino-1-pyridin-2-ylpyrazole-4-carboxylate
Also Known As: ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate, 4-EthylbiphenylAcetate, IFLab1_000838, ethyl 5-amino-1-pyridin-2-ylpyrazole-4-carboxylate, ethyl 5-amino-1-pyridin-2-yl-1H-pyrazole-4-carboxylate
| Molecular Formula | C11H12N4O2 |
|---|---|
| Molecular Weight | 232.10 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 83.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 232.09602 |
| Heavy Atoms | 17 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 69722-29-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(N=C1)C2=CC=CC=N2)N |
| InChIKey | UPTKQJLYDVZTKJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate (CAS 69722-29-8), with molecular formula C11H12N4O2 and molecular weight 232.10 g/mol. IUPAC: ethyl 5-amino-1-pyridin-2-ylpyrazole-4-carboxylate.
Chemical Property Profile of ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate
Property Insights of ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate. The TPSA of 83.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate. Following Lipinski's Rule of Five, ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate has 1 hydrogen bond donor(s) and 5 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 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate?
The CAS number of ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate is 69722-29-8.
What is the molecular formula of ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate?
The molecular formula of ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate is C11H12N4O2.
What is the molecular weight of ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate?
The molecular weight of ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate is 232.10 g/mol.
Where can I buy ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate?
You can request a quote for ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-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 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-amino-1-(pyridin-2-yl)-1H-pyrazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.