RefChem:246472
TL;DR: RefChem:246472 (CAS 20124-87-2) is a chemical compound with molecular formula C17H13F3N4O and molecular weight 346.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-2-phenyl-4-[[3-(trifluoromethyl)phenyl]diazenyl]-4H-pyrazol-3-one
Also Known As: 3-Methyl-1-phenyl-4-((3-(trifluoromethyl)phenyl)diazenyl)-1H-pyrazol-5(4H)-one, 2,4-Dihydro-5-methyl-2-phenyl-4-[2-[3-(trifluoromethyl)phenyl]diazenyl]-3H-pyrazol-3-one, 5-methyl-2-phenyl-4-{(E)-[3-(trifluoromethyl)phenyl]diazenyl}-2,4-dihydro-3H-pyrazol-3-one, 5-methyl-2-phenyl-4-[3-(trifluoromethyl)phenyl]diazenyl-4H-pyrazol-3-one, 2,4-Dihydro-5-methyl-2-phenyl-4-(2-(3-(trifluoromethyl)phenyl)diazenyl)-3H-pyrazol-3-one
| Molecular Formula | C17H13F3N4O |
|---|---|
| Molecular Weight | 346.10 g/mol |
| LogP | 4.5804 |
| Topological Polar Surface Area | 57.39 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 346.10416 |
| Heavy Atoms | 25 |
| Complexity | 846.4715 |
Chemical Identifiers
| CAS Number | 20124-87-2 |
|---|---|
| SMILES | CC1=NN(C(=O)C1N=NC2=CC=CC(=C2)C(F)(F)F)C3=CC=CC=C3 |
Product Overview
RefChem:246472 (CAS 20124-87-2), with molecular formula C17H13F3N4O and molecular weight 346.10 g/mol. IUPAC: 5-methyl-2-phenyl-4-[[3-(trifluoromethyl)phenyl]diazenyl]-4H-pyrazol-3-one.
Chemical Property Profile of RefChem:246472
Property Insights of RefChem:246472
The XLogP value of 4.5804 indicates that RefChem:246472 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.39 Ų, RefChem:246472 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:246472 has 0 hydrogen bond donor(s) and 4 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 RefChem:246472?
The CAS number of RefChem:246472 is 20124-87-2.
What is the molecular formula of RefChem:246472?
The molecular formula of RefChem:246472 is C17H13F3N4O.
What is the molecular weight of RefChem:246472?
The molecular weight of RefChem:246472 is 346.10 g/mol.
Where can I buy RefChem:246472?
You can request a quote for RefChem:246472 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:246472?
Yes, KEHONG BIO provides custom synthesis services for RefChem:246472 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.