5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one
TL;DR: 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one (CAS 413591-36-3) is a chemical compound with molecular formula C23H18N2O2 and molecular weight 354.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one
Also Known As: J3.477.227D, 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one, 3-Methyl-1-phenyl-4-(4-phenylbenzoyl)-1H-pyrazole-5(4H)-one, 4-(biphenyl-4-ylcarbonyl)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one, 4-{[1,1'-biphenyl]-4-carbonyl}-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazol-5-one
| Molecular Formula | C23H18N2O2 |
|---|---|
| Molecular Weight | 354.14 g/mol |
| LogP | 4.5752 |
| Topological Polar Surface Area | 49.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 354.13684 |
| Heavy Atoms | 27 |
| Complexity | 1009.2636 |
Chemical Identifiers
| CAS Number | 413591-36-3 |
|---|---|
| SMILES | CC1=NN(C(=O)C1C(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C4=CC=CC=C4 |
Product Overview
5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one (CAS 413591-36-3), with molecular formula C23H18N2O2 and molecular weight 354.14 g/mol. IUPAC: 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one.
Chemical Property Profile of 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one
Property Insights of 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one
The XLogP value of 4.5752 indicates that 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.74 Ų, 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one has 0 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 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one?
The CAS number of 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one is 413591-36-3.
What is the molecular formula of 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one?
The molecular formula of 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one is C23H18N2O2.
What is the molecular weight of 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one?
The molecular weight of 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one is 354.14 g/mol.
Where can I buy 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one?
You can request a quote for 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-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 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 5-methyl-2-phenyl-4-(4-phenylbenzoyl)-4H-pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.