(4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
TL;DR: (4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one (CAS 352693-07-3) is a chemical compound with molecular formula C19H18FN3O and molecular weight 323.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2,4-dimethylphenyl)iminomethyl]-2-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-one
Also Known As: (4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one, 4-[(2,4-dimethylanilino)methylidene]-2-(4-fluorophenyl)-5-methylpyrazol-3-one, 4-[[(2,4-dimethylphenyl)amino]methylidene]-2-(4-fluorophenyl)-5-methyl-pyrazol-3-one, 4-[(2,4-Dimethylanilino)methylidene]-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one, 4-[(Z)-1-(2,4-DIMETHYLANILINO)METHYLIDENE]-1-(4-FLUOROPHENYL)-3-METHYL-1H-PYRAZOL-5-ONE
| Molecular Formula | C19H18FN3O |
|---|---|
| Molecular Weight | 323.14 g/mol |
| LogP | 3.98056 |
| Topological Polar Surface Area | 50.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.1434 |
| Heavy Atoms | 24 |
| Complexity | 965.2673 |
Chemical Identifiers
| CAS Number | 352693-07-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N=CC2=C(NN(C2=O)C3=CC=C(C=C3)F)C)C |
Product Overview
(4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one (CAS 352693-07-3), with molecular formula C19H18FN3O and molecular weight 323.14 g/mol. IUPAC: 4-[(2,4-dimethylphenyl)iminomethyl]-2-(4-fluorophenyl)-5-methyl-1H-pyrazol-3-one.
Chemical Property Profile of (4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Property Insights of (4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
The XLogP value of 3.98056 indicates that (4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.15 Ų, (4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one has 1 hydrogen bond donor(s) and 2 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 (4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one?
The CAS number of (4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one is 352693-07-3.
What is the molecular formula of (4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one?
The molecular formula of (4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one is C19H18FN3O.
What is the molecular weight of (4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one?
The molecular weight of (4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one is 323.14 g/mol.
Where can I buy (4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one?
You can request a quote for (4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-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 (4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for (4Z)-4-{[(2,4-dimethylphenyl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.