4K-357S
TL;DR: 4K-357S (CAS 318247-64-2) is a chemical compound with molecular formula C26H24N2O4S and molecular weight 460.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-methyl-5-(4-methylphenyl)sulfonyl-3-phenylpyrazol-4-yl]methyl 3-methylbenzoate
Also Known As: 4K-357S, {1-methyl-5-[(4-methylphenyl)sulfonyl]-3-phenyl-1H-pyrazol-4-yl}methyl 3-methylbenzenecarboxylate, [1-methyl-5-(4-methylphenyl)sulfonyl-3-phenylpyrazol-4-yl]methyl 3-methylbenzoate, [1-methyl-5-(4-methylbenzenesulfonyl)-3-phenyl-1H-pyrazol-4-yl]methyl 3-methylbenzoate, [1-methyl-5-(4-methylbenzenesulfonyl)-3-phenyl-1H-pyrazol-4-yl]methyl3-methylbenzoate
| Molecular Formula | C26H24N2O4S |
|---|---|
| Molecular Weight | 460.15 g/mol |
| LogP | 4.89374 |
| Topological Polar Surface Area | 78.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 460.1457 |
| Heavy Atoms | 33 |
| Complexity | 1406.6897 |
Chemical Identifiers
| CAS Number | 318247-64-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C2=C(C(=NN2C)C3=CC=CC=C3)COC(=O)C4=CC=CC(=C4)C |
Product Overview
4K-357S (CAS 318247-64-2), with molecular formula C26H24N2O4S and molecular weight 460.15 g/mol. IUPAC: [1-methyl-5-(4-methylphenyl)sulfonyl-3-phenylpyrazol-4-yl]methyl 3-methylbenzoate.
Chemical Property Profile of 4K-357S
Property Insights of 4K-357S
The XLogP value of 4.89374 indicates that 4K-357S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 4K-357S. Following Lipinski's Rule of Five, 4K-357S has 0 hydrogen bond donor(s) and 5 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 4K-357S?
The CAS number of 4K-357S is 318247-64-2.
What is the molecular formula of 4K-357S?
The molecular formula of 4K-357S is C26H24N2O4S.
What is the molecular weight of 4K-357S?
The molecular weight of 4K-357S is 460.15 g/mol.
Where can I buy 4K-357S?
You can request a quote for 4K-357S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4K-357S?
Yes, KEHONG BIO provides custom synthesis services for 4K-357S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.