4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one)
TL;DR: 4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one) (CAS 49581-17-1) is a chemical compound with molecular formula C32H34N4O5 and molecular weight 554.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-(3,4,5-trimethoxyphenyl)methyl]-1,5-dimethyl-2-phenylpyrazol-3-one
Also Known As: 4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one), 4,4'-[(3,4,5-trimethoxyphenyl)methylene]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one), 4,4'-[(3,4,5-Trimethoxyphenyl)methylene]bis[1,2-dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one], 4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-(3,4,5-trimethoxyphenyl)methyl]-1,5-dimethyl-2-phenylpyrazol-3-one, 4,4'-[(3,4,5-trimethoxyphenyl)methanediyl]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)
| Molecular Formula | C32H34N4O5 |
|---|---|
| Molecular Weight | 554.25 g/mol |
| LogP | 4.48824 |
| Topological Polar Surface Area | 81.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 554.2529 |
| Heavy Atoms | 41 |
| Complexity | 1699.3771 |
Chemical Identifiers
| CAS Number | 49581-17-1 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(C3=CC(=C(C(=C3)OC)OC)OC)C4=C(N(N(C4=O)C5=CC=CC=C5)C)C |
Product Overview
4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one) (CAS 49581-17-1), with molecular formula C32H34N4O5 and molecular weight 554.25 g/mol. IUPAC: 4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-(3,4,5-trimethoxyphenyl)methyl]-1,5-dimethyl-2-phenylpyrazol-3-one.
Chemical Property Profile of 4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one)
Property Insights of 4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one)
The XLogP value of 4.48824 indicates that 4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one). Following Lipinski's Rule of Five, 4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one) has 0 hydrogen bond donor(s) and 5 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'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one)?
The CAS number of 4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one) is 49581-17-1.
What is the molecular formula of 4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one)?
The molecular formula of 4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one) is C32H34N4O5.
What is the molecular weight of 4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one)?
The molecular weight of 4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one) is 554.25 g/mol.
Where can I buy 4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one)?
You can request a quote for 4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one)?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-((3,4,5-trimethoxyphenyl)methylene)bis(1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.