![ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate structure](/static/products/5128/512809-05-1.webp)
ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate
TL;DR: ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate (CAS 512809-05-1) is a chemical compound with molecular formula C11H11BrN4O3 and molecular weight 326.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(4-bromopyrazole-1-carbonyl)-1-methylpyrazole-5-carboxylate
Also Known As: ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate, ethyl 5-(4-bromopyrazole-1-carbonyl)-2-methylpyrazole-3-carboxylate, Ethyl 5-(4-bromopyrazole-1-carbonyl)-2-methyl-pyrazole-3-carboxylate, ethyl 3-(4-bromo-1H-pyrazole-1-carbonyl)-1-methyl-1H-pyrazole-5-carboxylate
| Molecular Formula | C11H11BrN4O3 |
|---|---|
| Molecular Weight | 326.00 g/mol |
| LogP | 1.2443 |
| Topological Polar Surface Area | 79.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.00146 |
| Heavy Atoms | 19 |
| Complexity | 631.6739 |
Chemical Identifiers
| CAS Number | 512809-05-1 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=NN1C)C(=O)N2C=C(C=N2)Br |
Product Overview
ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate (CAS 512809-05-1), with molecular formula C11H11BrN4O3 and molecular weight 326.00 g/mol. IUPAC: ethyl 3-(4-bromopyrazole-1-carbonyl)-1-methylpyrazole-5-carboxylate.
Chemical Property Profile of ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate
Property Insights of ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate
The XLogP value of 1.2443 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate. The TPSA of 79.01 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate. Following Lipinski's Rule of Five, ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate has 0 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-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate?
The CAS number of ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate is 512809-05-1.
What is the molecular formula of ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate?
The molecular formula of ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate is C11H11BrN4O3.
What is the molecular weight of ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate?
The molecular weight of ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate is 326.00 g/mol.
Where can I buy ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate?
You can request a quote for ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-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 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-[(4-bromo-1H-pyrazol-1-yl)carbonyl]-1-methyl-1H-pyrazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.