(Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one
TL;DR: (Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one (CAS 799772-78-4) is a chemical compound with molecular formula C19H17N3O2 and molecular weight 319.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3-acetylphenyl)iminomethyl]-5-methyl-2-phenyl-1H-pyrazol-3-one
Also Known As: (Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one, 4-[(3-acetylanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one, (4Z)-4-[(3-acetylanilino)methylidene]-5-methyl-2-phenylpyrazol-3-one, (4Z)-4-{[(3-acetylphenyl)amino]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
| Molecular Formula | C19H17N3O2 |
|---|---|
| Molecular Weight | 319.13 g/mol |
| LogP | 3.42722 |
| Topological Polar Surface Area | 67.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.13208 |
| Heavy Atoms | 24 |
| Complexity | 965.77704 |
Chemical Identifiers
| CAS Number | 799772-78-4 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C2=CC=CC=C2)C=NC3=CC=CC(=C3)C(=O)C |
Product Overview
(Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one (CAS 799772-78-4), with molecular formula C19H17N3O2 and molecular weight 319.13 g/mol. IUPAC: 4-[(3-acetylphenyl)iminomethyl]-5-methyl-2-phenyl-1H-pyrazol-3-one.
Chemical Property Profile of (Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one
Property Insights of (Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one
The XLogP value of 3.42722 indicates that (Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.22 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one. Following Lipinski's Rule of Five, (Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one has 1 hydrogen bond donor(s) and 3 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 (Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one?
The CAS number of (Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one is 799772-78-4.
What is the molecular formula of (Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one?
The molecular formula of (Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one is C19H17N3O2.
What is the molecular weight of (Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one?
The molecular weight of (Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one is 319.13 g/mol.
Where can I buy (Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one?
You can request a quote for (Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for (Z)-4-(((3-acetylphenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazol-5(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.