methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one structure](/static/products/5634/5634-23-1.webp)
4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
TL;DR: 4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one (CAS 5634-23-1) is a chemical compound with molecular formula C29H27N5O4 and molecular weight 509.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-4-[[5-methyl-2-(4-methylphenyl)-3-oxo-1H-pyrazol-4-yl]-(2-nitrophenyl)methyl]-2-(4-methylphenyl)-4H-pyrazol-3-one
Also Known As: 4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one, 5-methyl-4-[[5-methyl-2-(4-methylphenyl)-3-oxo-1H-pyrazol-4-yl]-(2-nitrophenyl)methyl]-2-(4-methylphenyl)-4H-pyrazol-3-one
| Molecular Formula | C29H27N5O4 |
|---|---|
| Molecular Weight | 509.21 g/mol |
| LogP | 5.16986 |
| Topological Polar Surface Area | 113.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 509.2063 |
| Heavy Atoms | 38 |
| Complexity | 1630.9366 |
Chemical Identifiers
| CAS Number | 5634-23-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)C(C(=N2)C)C(C3=CC=CC=C3[N+](=O)[O-])C4=C(NN(C4=O)C5=CC=C(C=C5)C)C |
Product Overview
4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one (CAS 5634-23-1), with molecular formula C29H27N5O4 and molecular weight 509.21 g/mol. IUPAC: 5-methyl-4-[[5-methyl-2-(4-methylphenyl)-3-oxo-1H-pyrazol-4-yl]-(2-nitrophenyl)methyl]-2-(4-methylphenyl)-4H-pyrazol-3-one.
Chemical Property Profile of 4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
Property Insights of 4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
The XLogP value of 5.16986 indicates that 4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one. Following Lipinski's Rule of Five, 4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one has 1 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-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one?
The CAS number of 4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one is 5634-23-1.
What is the molecular formula of 4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one?
The molecular formula of 4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one is C29H27N5O4.
What is the molecular weight of 4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one?
The molecular weight of 4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one is 509.21 g/mol.
Where can I buy 4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one?
You can request a quote for 4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)-1H-pyrazol-4-yl](2-nitrophenyl)methyl]-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.