![(4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one structure](/static/products/4048/404895-99-4.webp)
(4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one
TL;DR: (4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one (CAS 404895-99-4) is a chemical compound with molecular formula C19H18N4O3 and molecular weight 350.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-4-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-2-(4-nitrophenyl)-1H-pyrazol-3-one
Also Known As: (4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one, (4E)-5-methyl-4-{1-[(4-methylphenyl)amino]ethylidene}-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one, 5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one, (4Z)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one, (E)-3-methyl-1-(4-nitrophenyl)-4-(1-(p-tolylamino)ethylidene)-1H-pyrazol-5(4H)-one
| Molecular Formula | C19H18N4O3 |
|---|---|
| Molecular Weight | 350.14 g/mol |
| LogP | 3.83134 |
| Topological Polar Surface Area | 93.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.13788 |
| Heavy Atoms | 26 |
| Complexity | 1041.8834 |
Chemical Identifiers
| CAS Number | 404895-99-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N=C(C)C2=C(NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-])C |
Product Overview
(4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one (CAS 404895-99-4), with molecular formula C19H18N4O3 and molecular weight 350.14 g/mol. IUPAC: 5-methyl-4-[C-methyl-N-(4-methylphenyl)carbonimidoyl]-2-(4-nitrophenyl)-1H-pyrazol-3-one.
Chemical Property Profile of (4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one
Property Insights of (4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one
The XLogP value of 3.83134 indicates that (4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.29 Ų falls within the moderate polarity range, balancing permeability and solubility for (4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one. Following Lipinski's Rule of Five, (4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one has 1 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 (4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one?
The CAS number of (4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one is 404895-99-4.
What is the molecular formula of (4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one?
The molecular formula of (4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one is C19H18N4O3.
What is the molecular weight of (4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one?
The molecular weight of (4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one is 350.14 g/mol.
Where can I buy (4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one?
You can request a quote for (4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)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 (4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for (4E)-5-methyl-4-[1-(4-methylanilino)ethylidene]-2-(4-nitrophenyl)pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.