(3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone
TL;DR: (3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone (CAS 394236-48-7) is a chemical compound with molecular formula C19H17FN2OS and molecular weight 340.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,5-dimethyl-4-(4-methylphenyl)sulfanylpyrazol-1-yl]-(4-fluorophenyl)methanone
Also Known As: (3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone, 1-(4-fluorobenzoyl)-3,5-dimethyl-4-[(4-methylphenyl)sulfanyl]-1H-pyrazole, F0755-0031, [3,5-dimethyl-4-(4-methylphenyl)sulfanylpyrazol-1-yl]-(4-fluorophenyl)methanone, 1-(4-fluorobenzoyl)-3,5-dimethyl-4-[(4-methylphenyl)thio]-1H-pyrazole
| Molecular Formula | C19H17FN2OS |
|---|---|
| Molecular Weight | 340.10 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 60.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 340.10455 |
| Heavy Atoms | 24 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 394236-48-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SC2=C(N(N=C2C)C(=O)C3=CC=C(C=C3)F)C |
| InChIKey | CDGQSICUOSVLGX-UHFFFAOYSA-N |
Product Overview
(3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone (CAS 394236-48-7), with molecular formula C19H17FN2OS and molecular weight 340.10 g/mol. IUPAC: [3,5-dimethyl-4-(4-methylphenyl)sulfanylpyrazol-1-yl]-(4-fluorophenyl)methanone.
Chemical Property Profile of (3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone
Property Insights of (3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone
The XLogP value of 5.1 indicates that (3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.2 Ų falls within the moderate polarity range, balancing permeability and solubility for (3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone. Following Lipinski's Rule of Five, (3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone?
The CAS number of (3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone is 394236-48-7.
What is the molecular formula of (3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone?
The molecular formula of (3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone is C19H17FN2OS.
What is the molecular weight of (3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone?
The molecular weight of (3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone is 340.10 g/mol.
Where can I buy (3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone?
You can request a quote for (3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (3,5-dimethyl-4-(p-tolylthio)-1H-pyrazol-1-yl)(4-fluorophenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.