3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)-
TL;DR: 3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)- (CAS 24428-83-9) is a chemical compound with molecular formula C20H18N2O2 and molecular weight 318.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-4-[(E)-3-(4-methylphenyl)-3-oxoprop-1-enyl]-2-phenyl-1H-pyrazol-3-one
Also Known As: 3-Methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)-3-pyrazolin-5-one, 5-24-08-00289 (Beilstein Handbook Reference), 3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)-, 5-methyl-4-[(E)-3-(4-methylphenyl)-3-oxoprop-1-enyl]-2-phenyl-1H-pyrazol-3-one, RefChem:1068566
| Molecular Formula | C20H18N2O2 |
|---|---|
| Molecular Weight | 318.14 g/mol |
| LogP | 3.67854 |
| Topological Polar Surface Area | 54.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 318.13684 |
| Heavy Atoms | 24 |
| Complexity | 945.55396 |
Chemical Identifiers
| CAS Number | 24428-83-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)/C=C/C2=C(NN(C2=O)C3=CC=CC=C3)C |
Product Overview
3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)- (CAS 24428-83-9), with molecular formula C20H18N2O2 and molecular weight 318.14 g/mol. IUPAC: 5-methyl-4-[(E)-3-(4-methylphenyl)-3-oxoprop-1-enyl]-2-phenyl-1H-pyrazol-3-one.
Chemical Property Profile of 3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)-
Property Insights of 3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)-
The XLogP value of 3.67854 indicates that 3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.86 Ų, 3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)- 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 3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)-?
The CAS number of 3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)- is 24428-83-9.
What is the molecular formula of 3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)-?
The molecular formula of 3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)- is C20H18N2O2.
What is the molecular weight of 3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)-?
The molecular weight of 3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)- is 318.14 g/mol.
Where can I buy 3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)-?
You can request a quote for 3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)-?
Yes, KEHONG BIO provides custom synthesis services for 3-Pyrazolin-5-one, 3-methyl-1-phenyl-4-(2-(p-toluoyl)vinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.