S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate
TL;DR: S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate (CAS 324579-63-7) is a chemical compound with molecular formula C23H18N2O3S2 and molecular weight 434.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-[5-(4-methylphenyl)sulfonyl-2-phenyl-1H-imidazol-4-yl] benzenecarbothioate
Also Known As: BAS 00918068, S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate, AB00674387-01, F1430-0115, 4-[(4-methylphenyl)sulfonyl]-2-phenylimidazol-5-ylthio phenyl ketone
| Molecular Formula | C23H18N2O3S2 |
|---|---|
| Molecular Weight | 434.08 g/mol |
| LogP | 5.15042 |
| Topological Polar Surface Area | 79.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 434.0759 |
| Heavy Atoms | 30 |
| Complexity | 1281.5547 |
Chemical Identifiers
| CAS Number | 324579-63-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C2=C(N=C(N2)C3=CC=CC=C3)SC(=O)C4=CC=CC=C4 |
Product Overview
S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate (CAS 324579-63-7), with molecular formula C23H18N2O3S2 and molecular weight 434.08 g/mol. IUPAC: S-[5-(4-methylphenyl)sulfonyl-2-phenyl-1H-imidazol-4-yl] benzenecarbothioate.
Chemical Property Profile of S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate
Property Insights of S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate
The XLogP value of 5.15042 indicates that S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.89 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate. Following Lipinski's Rule of Five, S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate?
The CAS number of S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate is 324579-63-7.
What is the molecular formula of S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate?
The molecular formula of S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate is C23H18N2O3S2.
What is the molecular weight of S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate?
The molecular weight of S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate is 434.08 g/mol.
Where can I buy S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate?
You can request a quote for S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate?
Yes, KEHONG BIO provides custom synthesis services for S-(2-phenyl-4-tosyl-1H-imidazol-5-yl) benzothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.