Ethyl 3,5-diamino-1H-pyrazole-4-carboxylate
TL;DR: Ethyl 3,5-diamino-1H-pyrazole-4-carboxylate (CAS 6825-71-4) is a chemical compound with molecular formula C6H10N4O2 and molecular weight 170.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3,5-diamino-1H-pyrazole-4-carboxylate
Also Known As: Ethyl 3,5-diamino-1H-pyrazole-4-carboxylate, Ethyl 3,5-diamino-4-pyrazolecarboxylate, 3,5-Diamino-1H-pyrazole-4-carboxylic acid ethyl ester, 0520AC, ethyl 3,5-diaminopyrazole-4-carboxylate
| Molecular Formula | C6H10N4O2 |
|---|---|
| Molecular Weight | 170.08 g/mol |
| LogP | -0.2492 |
| Topological Polar Surface Area | 107.02 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.08037 |
| Heavy Atoms | 12 |
| Complexity | 274.23822 |
Chemical Identifiers
| CAS Number | 6825-71-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(NN=C1N)N |
Product Overview
Ethyl 3,5-diamino-1H-pyrazole-4-carboxylate (CAS 6825-71-4), with molecular formula C6H10N4O2 and molecular weight 170.08 g/mol. IUPAC: ethyl 3,5-diamino-1H-pyrazole-4-carboxylate.
Chemical Property Profile of Ethyl 3,5-diamino-1H-pyrazole-4-carboxylate
Property Insights of Ethyl 3,5-diamino-1H-pyrazole-4-carboxylate
The XLogP value of -0.2492 indicates that Ethyl 3,5-diamino-1H-pyrazole-4-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 107.02 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3,5-diamino-1H-pyrazole-4-carboxylate. Following Lipinski's Rule of Five, Ethyl 3,5-diamino-1H-pyrazole-4-carboxylate has 3 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 3,5-diamino-1H-pyrazole-4-carboxylate?
The CAS number of Ethyl 3,5-diamino-1H-pyrazole-4-carboxylate is 6825-71-4.
What is the molecular formula of Ethyl 3,5-diamino-1H-pyrazole-4-carboxylate?
The molecular formula of Ethyl 3,5-diamino-1H-pyrazole-4-carboxylate is C6H10N4O2.
What is the molecular weight of Ethyl 3,5-diamino-1H-pyrazole-4-carboxylate?
The molecular weight of Ethyl 3,5-diamino-1H-pyrazole-4-carboxylate is 170.08 g/mol.
Where can I buy Ethyl 3,5-diamino-1H-pyrazole-4-carboxylate?
You can request a quote for Ethyl 3,5-diamino-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 3,5-diamino-1H-pyrazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3,5-diamino-1H-pyrazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.