4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione
TL;DR: 4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione (CAS 5551-93-9) is a chemical compound with molecular formula C18H15BrN2O3 and molecular weight 386.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-4-[(5-bromo-2-ethoxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
Also Known As: BIM-0048314.P001, 4-(5-bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione, (4Z)-4-[(5-bromo-2-ethoxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione
| Molecular Formula | C18H15BrN2O3 |
|---|---|
| Molecular Weight | 386.03 g/mol |
| LogP | 3.3092 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 386.0266 |
| Heavy Atoms | 24 |
| Complexity | 818.2685 |
Chemical Identifiers
| CAS Number | 5551-93-9 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)Br)/C=C\2/C(=O)NN(C2=O)C3=CC=CC=C3 |
Product Overview
4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione (CAS 5551-93-9), with molecular formula C18H15BrN2O3 and molecular weight 386.03 g/mol. IUPAC: (4Z)-4-[(5-bromo-2-ethoxyphenyl)methylidene]-1-phenylpyrazolidine-3,5-dione.
Chemical Property Profile of 4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione
Property Insights of 4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione
The XLogP value of 3.3092 indicates that 4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, 4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione has 1 hydrogen bond donor(s) and 3 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 4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione?
The CAS number of 4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione is 5551-93-9.
What is the molecular formula of 4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione?
The molecular formula of 4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione is C18H15BrN2O3.
What is the molecular weight of 4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione?
The molecular weight of 4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione is 386.03 g/mol.
Where can I buy 4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione?
You can request a quote for 4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione?
Yes, KEHONG BIO provides custom synthesis services for 4-(5-Bromo-2-ethoxybenzylidene)-1-phenyl-3,5-pyrazolidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.