4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole
TL;DR: 4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole (CAS 394236-89-6) is a chemical compound with molecular formula C18H17ClN2O2S2 and molecular weight 392.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)sulfanyl-3,5-dimethyl-1-(4-methylphenyl)sulfonylpyrazole
Also Known As: 4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole, F0755-0081, 4-(4-chlorophenyl)sulfanyl-3,5-dimethyl-1-(4-methylphenyl)sulfonylpyrazole, 4-[(4-CHLOROPHENYL)SULFANYL]-3,5-DIMETHYL-1-(4-METHYLBENZENESULFONYL)-1H-PYRAZOLE, 4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1-[(4-methylbenzene)sulfonyl]-1H-pyrazole
| Molecular Formula | C18H17ClN2O2S2 |
|---|---|
| Molecular Weight | 392.04 g/mol |
| LogP | 4.84996 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 392.042 |
| Heavy Atoms | 25 |
| Complexity | 1008.4797 |
Chemical Identifiers
| CAS Number | 394236-89-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2C(=C(C(=N2)C)SC3=CC=C(C=C3)Cl)C |
Product Overview
4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole (CAS 394236-89-6), with molecular formula C18H17ClN2O2S2 and molecular weight 392.04 g/mol. IUPAC: 4-(4-chlorophenyl)sulfanyl-3,5-dimethyl-1-(4-methylphenyl)sulfonylpyrazole.
Chemical Property Profile of 4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole
Property Insights of 4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole
The XLogP value of 4.84996 indicates that 4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.96 Ų, 4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole 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 4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole?
The CAS number of 4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole is 394236-89-6.
What is the molecular formula of 4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole?
The molecular formula of 4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole is C18H17ClN2O2S2.
What is the molecular weight of 4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole?
The molecular weight of 4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole is 392.04 g/mol.
Where can I buy 4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole?
You can request a quote for 4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 4-((4-chlorophenyl)thio)-3,5-dimethyl-1-tosyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.