![4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one structure](/static/products/518/518995-90-9.png)
4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
TL;DR: 4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one (CAS 518995-90-9) is a chemical compound with molecular formula C23H17ClN4O3 and molecular weight 432.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[N-(4-chlorophenyl)-C-methylcarbonimidoyl]-2-(4-nitrophenyl)-5-phenyl-1H-pyrazol-3-one
Also Known As: 4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one, 4-[1-(4-chloroanilino)ethylidene]-2-(4-nitrophenyl)-5-phenylpyrazol-3-one, (4E)-4-[1-(4-chloroanilino)ethylidene]-2-(4-nitrophenyl)-5-phenylpyrazol-3-one, (4Z)-4-[1-(4-chloroanilino)ethylidene]-2-(4-nitrophenyl)-5-phenylpyrazol-3-one, (E)-4-(1-((4-chlorophenyl)imino)ethyl)-2-(4-nitrophenyl)-5-phenyl-1H-pyrazol-3(2H)-one
| Molecular Formula | C23H17ClN4O3 |
|---|---|
| Molecular Weight | 432.10 g/mol |
| LogP | 5.5349 |
| Topological Polar Surface Area | 93.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 432.0989 |
| Heavy Atoms | 31 |
| Complexity | 1322.2567 |
Chemical Identifiers
| CAS Number | 518995-90-9 |
|---|---|
| SMILES | CC(=NC1=CC=C(C=C1)Cl)C2=C(NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4 |
Product Overview
4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one (CAS 518995-90-9), with molecular formula C23H17ClN4O3 and molecular weight 432.10 g/mol. IUPAC: 4-[N-(4-chlorophenyl)-C-methylcarbonimidoyl]-2-(4-nitrophenyl)-5-phenyl-1H-pyrazol-3-one.
Chemical Property Profile of 4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
Property Insights of 4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
The XLogP value of 5.5349 indicates that 4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-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 4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one. Following Lipinski's Rule of Five, 4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one?
The CAS number of 4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one is 518995-90-9.
What is the molecular formula of 4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one?
The molecular formula of 4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one is C23H17ClN4O3.
What is the molecular weight of 4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one?
The molecular weight of 4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one is 432.10 g/mol.
Where can I buy 4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one?
You can request a quote for 4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-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-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 4-[(1E)-N-(4-chlorophenyl)ethanimidoyl]-2-(4-nitrophenyl)-5-phenyl-1,2-dihydro-3H-pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.