1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione
TL;DR: 1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione (CAS 345322-13-6) is a chemical compound with molecular formula C19H17BrN2O5 and molecular weight 432.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-1-(4-bromophenyl)-4-[(3,4,5-trimethoxyphenyl)methylidene]pyrazolidine-3,5-dione
Also Known As: AB00119582-01, 1-(4-bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione, (4E)-1-(4-bromophenyl)-4-[(3,4,5-trimethoxyphenyl)methylidene]pyrazolidine-3,5-dione
| Molecular Formula | C19H17BrN2O5 |
|---|---|
| Molecular Weight | 432.03 g/mol |
| LogP | 2.9363 |
| Topological Polar Surface Area | 77.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 432.03207 |
| Heavy Atoms | 27 |
| Complexity | 899.1924 |
Chemical Identifiers
| CAS Number | 345322-13-6 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)/C=C/2\C(=O)NN(C2=O)C3=CC=C(C=C3)Br |
Product Overview
1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione (CAS 345322-13-6), with molecular formula C19H17BrN2O5 and molecular weight 432.03 g/mol. IUPAC: (4E)-1-(4-bromophenyl)-4-[(3,4,5-trimethoxyphenyl)methylidene]pyrazolidine-3,5-dione.
Chemical Property Profile of 1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione
Property Insights of 1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione
The XLogP value of 2.9363 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione. The TPSA of 77.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione. Following Lipinski's Rule of Five, 1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione 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 1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione?
The CAS number of 1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione is 345322-13-6.
What is the molecular formula of 1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione?
The molecular formula of 1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione is C19H17BrN2O5.
What is the molecular weight of 1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione?
The molecular weight of 1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione is 432.03 g/mol.
Where can I buy 1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione?
You can request a quote for 1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-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 1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromophenyl)-4-(3,4,5-trimethoxybenzylidene)-3,5-pyrazolidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.