![Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]- structure](/static/products/1590/15908-53-9.webp)
Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]-
TL;DR: Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]- (CAS 15908-53-9) is a chemical compound with molecular formula C13H14N2OS and molecular weight 246.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-methyl-3-methylsulfanyl-1-phenylpyrazol-4-yl)ethanone
Also Known As: Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]-, 1-(5-methyl-3-methylsulfanyl-1-phenylpyrazol-4-yl)ethanone, 1-(5-Methyl-3-(methylthio)-1-phenyl-1H-pyrazol-4-yl)ethanone, 1-[5-Methyl-3-(methylsulfanyl)-1-phenyl-1H-pyrazol-4-yl]ethan-1-one
| Molecular Formula | C13H14N2OS |
|---|---|
| Molecular Weight | 246.08 g/mol |
| LogP | 3.10522 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.08269 |
| Heavy Atoms | 17 |
| Complexity | 546.0471 |
Chemical Identifiers
| CAS Number | 15908-53-9 |
|---|---|
| SMILES | CC1=C(C(=NN1C2=CC=CC=C2)SC)C(=O)C |
Product Overview
Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]- (CAS 15908-53-9), with molecular formula C13H14N2OS and molecular weight 246.08 g/mol. IUPAC: 1-(5-methyl-3-methylsulfanyl-1-phenylpyrazol-4-yl)ethanone.
Chemical Property Profile of Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]-
Property Insights of Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]-
The XLogP value of 3.10522 indicates that Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]- 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 Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]-?
The CAS number of Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]- is 15908-53-9.
What is the molecular formula of Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]-?
The molecular formula of Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]- is C13H14N2OS.
What is the molecular weight of Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]-?
The molecular weight of Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]- is 246.08 g/mol.
Where can I buy Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]-?
You can request a quote for Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-[5-methyl-3-(methylthio)-1-phenylpyrazol-4-yl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.