ethyl 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate
TL;DR: ethyl 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate (CAS 78348-13-7) is a chemical compound with molecular formula C12H11BrN2O3 and molecular weight 310.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(4-bromophenyl)-4-hydroxypyrazole-3-carboxylate
Also Known As: ethyl 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate, ethyl 1-(4-bromophenyl)-4-hydroxypyrazole-3-carboxylate, F1174-1792, ethyl 1-(4-bromophenyl)-4-hydroxy-pyrazole-3-carboxylate
| Molecular Formula | C12H11BrN2O3 |
|---|---|
| Molecular Weight | 310.00 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 309.9953 |
| Heavy Atoms | 18 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 78348-13-7 |
|---|---|
| SMILES | CCOC(=O)C1=NN(C=C1O)C2=CC=C(C=C2)Br |
| InChIKey | SQFZPNSZENSXAW-UHFFFAOYSA-N |
Product Overview
ethyl 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate (CAS 78348-13-7), with molecular formula C12H11BrN2O3 and molecular weight 310.00 g/mol. IUPAC: ethyl 1-(4-bromophenyl)-4-hydroxypyrazole-3-carboxylate.
Chemical Property Profile of ethyl 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate
Property Insights of ethyl 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate
The XLogP value of 3.3 indicates that ethyl 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate. Following Lipinski's Rule of Five, ethyl 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate has 1 hydrogen bond donor(s) and 4 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 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate?
The CAS number of ethyl 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate is 78348-13-7.
What is the molecular formula of ethyl 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate?
The molecular formula of ethyl 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate is C12H11BrN2O3.
What is the molecular weight of ethyl 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate?
The molecular weight of ethyl 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate is 310.00 g/mol.
Where can I buy ethyl 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate?
You can request a quote for ethyl 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-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 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 1-(4-bromophenyl)-4-hydroxy-1H-pyrazole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.