ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate
TL;DR: ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate (CAS 340295-64-9) is a chemical compound with molecular formula C19H16BrClN2O3 and molecular weight 434.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate
Also Known As: ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate, ethyl 4-(3-bromophenyl)-5-[(4-chlorophenyl)carbonyl]-4,5-dihydro-1H-pyrazole-3-carboxylate
| Molecular Formula | C19H16BrClN2O3 |
|---|---|
| Molecular Weight | 434.00 g/mol |
| LogP | 3.9599 |
| Topological Polar Surface Area | 67.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 434.00327 |
| Heavy Atoms | 26 |
| Complexity | 867.3429 |
Chemical Identifiers
| CAS Number | 340295-64-9 |
|---|---|
| SMILES | CCOC(=O)C1=NNC(C1C2=CC(=CC=C2)Br)C(=O)C3=CC=C(C=C3)Cl |
Product Overview
ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate (CAS 340295-64-9), with molecular formula C19H16BrClN2O3 and molecular weight 434.00 g/mol. IUPAC: ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate.
Chemical Property Profile of ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate
Property Insights of ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate
The XLogP value of 3.9599 indicates that ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.76 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate. Following Lipinski's Rule of Five, ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-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 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate?
The CAS number of ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate is 340295-64-9.
What is the molecular formula of ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate?
The molecular formula of ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate is C19H16BrClN2O3.
What is the molecular weight of ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate?
The molecular weight of ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate is 434.00 g/mol.
Where can I buy ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate?
You can request a quote for ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-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 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-(3-bromophenyl)-5-(4-chlorobenzoyl)-4,5-dihydro-1H-pyrazole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.