1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one
TL;DR: 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one (CAS 100375-10-8) is a chemical compound with molecular formula C17H16N2O and molecular weight 264.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4-dimethylphenyl)-5-phenyl-4H-pyrazol-3-one
Also Known As: 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one, 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazol-5(4H)-one, 2-(2,4-dimethylphenyl)-5-phenyl-4H-pyrazol-3-one, 7148AC, s11152
| Molecular Formula | C17H16N2O |
|---|---|
| Molecular Weight | 264.13 g/mol |
| LogP | 3.44444 |
| Topological Polar Surface Area | 32.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 264.12625 |
| Heavy Atoms | 20 |
| Complexity | 689.3911 |
Chemical Identifiers
| CAS Number | 100375-10-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2C(=O)CC(=N2)C3=CC=CC=C3)C |
Product Overview
1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one (CAS 100375-10-8), with molecular formula C17H16N2O and molecular weight 264.13 g/mol. IUPAC: 2-(2,4-dimethylphenyl)-5-phenyl-4H-pyrazol-3-one.
Chemical Property Profile of 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one
Property Insights of 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one
The XLogP value of 3.44444 indicates that 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.67 Ų, 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one has 0 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 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one?
The CAS number of 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one is 100375-10-8.
What is the molecular formula of 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one?
The molecular formula of 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one is C17H16N2O.
What is the molecular weight of 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one?
The molecular weight of 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one is 264.13 g/mol.
Where can I buy 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one?
You can request a quote for 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-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 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4-Dimethylphenyl)-3-phenyl-1H-pyrazole-5(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.