5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole
TL;DR: 5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole (CAS 671754-10-2) is a chemical compound with molecular formula C16H14N2OS and molecular weight 282.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylsulfanyl-5-(4-phenoxyphenyl)-1H-pyrazole
Also Known As: Cyto3D5, 5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole, Maybridge1_003247, 3-Methylamino-1,2-propanediol, 5- -3- -1H-PYRAZOLE
| Molecular Formula | C16H14N2OS |
|---|---|
| Molecular Weight | 282.08 g/mol |
| LogP | 4.5909 |
| Topological Polar Surface Area | 37.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 282.08267 |
| Heavy Atoms | 20 |
| Complexity | 677.2113 |
Chemical Identifiers
| CAS Number | 671754-10-2 |
|---|---|
| SMILES | CSC1=NNC(=C1)C2=CC=C(C=C2)OC3=CC=CC=C3 |
Product Overview
5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole (CAS 671754-10-2), with molecular formula C16H14N2OS and molecular weight 282.08 g/mol. IUPAC: 3-methylsulfanyl-5-(4-phenoxyphenyl)-1H-pyrazole.
Chemical Property Profile of 5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole
Property Insights of 5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole
The XLogP value of 4.5909 indicates that 5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.91 Ų, 5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole has 1 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-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole?
The CAS number of 5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole is 671754-10-2.
What is the molecular formula of 5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole?
The molecular formula of 5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole is C16H14N2OS.
What is the molecular weight of 5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole?
The molecular weight of 5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole is 282.08 g/mol.
Where can I buy 5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole?
You can request a quote for 5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(methylthio)-3-(4-phenoxyphenyl)-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.