4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol)
TL;DR: 4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol) (CAS 312309-60-7) is a chemical compound with molecular formula C34H38N4O3 and molecular weight 550.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-heptoxyphenyl)-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one
Also Known As: BAS 00402935, 4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol), 4,4'-{[2-(heptyloxy)phenyl]methanediyl}bis(3-methyl-1-phenyl-1H-pyrazol-5-ol), 4,4'-{[2-(heptyloxy)phenyl]methylene}bis(3-methyl-1-phenyl-1H-pyrazol-5-ol), 4-[(2-heptoxyphenyl)-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one
| Molecular Formula | C34H38N4O3 |
|---|---|
| Molecular Weight | 550.29 g/mol |
| LogP | 6.79084 |
| Topological Polar Surface Area | 84.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 550.2944 |
| Heavy Atoms | 41 |
| Complexity | 1595.8253 |
Chemical Identifiers
| CAS Number | 312309-60-7 |
|---|---|
| SMILES | CCCCCCCOC1=CC=CC=C1C(C2=C(NN(C2=O)C3=CC=CC=C3)C)C4=C(NN(C4=O)C5=CC=CC=C5)C |
Product Overview
4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol) (CAS 312309-60-7), with molecular formula C34H38N4O3 and molecular weight 550.29 g/mol. IUPAC: 4-[(2-heptoxyphenyl)-(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methyl]-5-methyl-2-phenyl-1H-pyrazol-3-one.
Chemical Property Profile of 4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol)
Property Insights of 4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol)
The XLogP value of 6.79084 indicates that 4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol). Following Lipinski's Rule of Five, 4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol) has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol)?
The CAS number of 4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol) is 312309-60-7.
What is the molecular formula of 4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol)?
The molecular formula of 4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol) is C34H38N4O3.
What is the molecular weight of 4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol)?
The molecular weight of 4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol) is 550.29 g/mol.
Where can I buy 4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol)?
You can request a quote for 4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-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'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol)?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-((2-(heptyloxy)phenyl)methylene)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.