![(4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one structure](/static/products/4288/428847-60-3.webp)
(4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one
TL;DR: (4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one (CAS 428847-60-3) is a chemical compound with molecular formula C23H17ClN4O4 and molecular weight 448.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-chlorophenyl)iminomethyl]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-1H-pyrazol-3-one
Also Known As: (4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one, (4Z)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one, 4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one, 4-[[(4-chlorophenyl)amino]methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one, (4Z)-4-{[(4-chlorophenyl)amino]methylene}-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one
| Molecular Formula | C23H17ClN4O4 |
|---|---|
| Molecular Weight | 448.09 g/mol |
| LogP | 5.1534 |
| Topological Polar Surface Area | 102.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 448.09384 |
| Heavy Atoms | 32 |
| Complexity | 1339.0144 |
Chemical Identifiers
| CAS Number | 428847-60-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=C(C(=O)N(N2)C3=CC=C(C=C3)[N+](=O)[O-])C=NC4=CC=C(C=C4)Cl |
Product Overview
(4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one (CAS 428847-60-3), with molecular formula C23H17ClN4O4 and molecular weight 448.09 g/mol. IUPAC: 4-[(4-chlorophenyl)iminomethyl]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)-1H-pyrazol-3-one.
Chemical Property Profile of (4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one
Property Insights of (4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one
The XLogP value of 5.1534 indicates that (4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.52 Ų falls within the moderate polarity range, balancing permeability and solubility for (4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one. Following Lipinski's Rule of Five, (4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)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 (4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one?
The CAS number of (4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one is 428847-60-3.
What is the molecular formula of (4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one?
The molecular formula of (4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one is C23H17ClN4O4.
What is the molecular weight of (4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one?
The molecular weight of (4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one is 448.09 g/mol.
Where can I buy (4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one?
You can request a quote for (4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-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)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for (4E)-4-[(4-chloroanilino)methylidene]-5-(4-methoxyphenyl)-2-(4-nitrophenyl)pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.