4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol)
TL;DR: 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol) (CAS 433698-18-1) is a chemical compound with molecular formula C24H26N4O4 and molecular weight 434.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-ethoxy-4-phenylmethoxyphenyl)-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1,2-dihydropyrazol-3-one
Also Known As: 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol), 4,4'-((4-(benzyloxy)-3-ethoxyphenyl)methylene)bis(3-methyl-1H-pyrazol-5-ol), 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methylene}bis(3-methyl-1H-pyrazol-5-ol), 4-[(3-ethoxy-4-phenylmethoxyphenyl)-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1,2-dihydropyrazol-3-one, 4-[[4-(benzyloxy)-3-ethoxyphenyl](5-hydroxy-3-methyl-1H-pyrazol-4-yl)methyl]-3-methyl-1H-pyrazol-5-ol
| Molecular Formula | C24H26N4O4 |
|---|---|
| Molecular Weight | 434.20 g/mol |
| LogP | 3.49414 |
| Topological Polar Surface Area | 115.76 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 434.1954 |
| Heavy Atoms | 32 |
| Complexity | 1259.5204 |
Chemical Identifiers
| CAS Number | 433698-18-1 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C(C2=C(NNC2=O)C)C3=C(NNC3=O)C)OCC4=CC=CC=C4 |
Product Overview
4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol) (CAS 433698-18-1), with molecular formula C24H26N4O4 and molecular weight 434.20 g/mol. IUPAC: 4-[(3-ethoxy-4-phenylmethoxyphenyl)-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)methyl]-5-methyl-1,2-dihydropyrazol-3-one.
Chemical Property Profile of 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol)
Property Insights of 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol)
The XLogP value of 3.49414 indicates that 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol). Following Lipinski's Rule of Five, 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol) has 4 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 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol)?
The CAS number of 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol) is 433698-18-1.
What is the molecular formula of 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol)?
The molecular formula of 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol) is C24H26N4O4.
What is the molecular weight of 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol)?
The molecular weight of 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol) is 434.20 g/mol.
Where can I buy 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol)?
You can request a quote for 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol)?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-{[4-(benzyloxy)-3-ethoxyphenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.