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Ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate
TL;DR: Ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate (CAS 6841-01-6) is a chemical compound with molecular formula C8H9N5O2 and molecular weight 207.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate
Also Known As: Ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate, ChemDiv2_002636, ethyl 4-aminopyrazolo[3,2-c][1,2,4]triazine-3-carboxylate, Ethyl 4-aminopyrazolo5,1-c1,2,4triazine-3-carboxylate, Pyrazolo[5,1-c][1,2,4]triazine-3-carboxylic acid, 4-amino-, ethyl ester
| Molecular Formula | C8H9N5O2 |
|---|---|
| Molecular Weight | 207.08 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 95.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.07562 |
| Heavy Atoms | 15 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 6841-01-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(N2C(=CC=N2)N=N1)N |
| InChIKey | QJDZRXLGQGLJIY-UHFFFAOYSA-N |
Product Overview
Ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate (CAS 6841-01-6), with molecular formula C8H9N5O2 and molecular weight 207.08 g/mol. IUPAC: ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate.
Chemical Property Profile of Ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate
Property Insights of Ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate. The TPSA of 95.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate has 1 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-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate?
The CAS number of Ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate is 6841-01-6.
What is the molecular formula of Ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate?
The molecular formula of Ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate is C8H9N5O2.
What is the molecular weight of Ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate?
The molecular weight of Ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate is 207.08 g/mol.
Where can I buy Ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate?
You can request a quote for Ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-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-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.