4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
TL;DR: 4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one (CAS 5851-74-1) is a chemical compound with molecular formula C24H19N3O5 and molecular weight 429.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(2,5-dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-5-phenylpyrazol-3-one
Also Known As: 4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one, (4E)-4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one, (4E)-4-[(2,5-dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-5-phenylpyrazol-3-one, 4-[(2,5-dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-5-phenyl-pyrazol-3-one, (4E)-4-[(2,5-Dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
| Molecular Formula | C24H19N3O5 |
|---|---|
| Molecular Weight | 429.13 g/mol |
| LogP | 4.4465 |
| Topological Polar Surface Area | 94.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 429.13248 |
| Heavy Atoms | 32 |
| Complexity | 1234.2494 |
Chemical Identifiers
| CAS Number | 5851-74-1 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)OC)/C=C/2\C(=NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4 |
Product Overview
4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one (CAS 5851-74-1), with molecular formula C24H19N3O5 and molecular weight 429.13 g/mol. IUPAC: (4E)-4-[(2,5-dimethoxyphenyl)methylidene]-2-(4-nitrophenyl)-5-phenylpyrazol-3-one.
Chemical Property Profile of 4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
Property Insights of 4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one
The XLogP value of 4.4465 indicates that 4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one. Following Lipinski's Rule of Five, 4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one has 0 hydrogen bond donor(s) and 6 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-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one?
The CAS number of 4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one is 5851-74-1.
What is the molecular formula of 4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one?
The molecular formula of 4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one is C24H19N3O5.
What is the molecular weight of 4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one?
The molecular weight of 4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one is 429.13 g/mol.
Where can I buy 4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one?
You can request a quote for 4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-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-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(2,5-dimethoxybenzylidene)-2-(4-nitrophenyl)-5-phenyl-2,4-dihydro-3H-pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.