S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate
TL;DR: S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate (CAS 164398-64-5) is a chemical compound with molecular formula C24H19ClN2O4S2 and molecular weight 498.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-[2-(4-methoxyphenyl)-5-(4-methylphenyl)sulfonyl-1H-imidazol-4-yl] 4-chlorobenzenecarbothioate
Also Known As: S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate, S-[2-(4-methoxyphenyl)-5-(4-methylphenyl)sulfonyl-1H-imidazol-4-yl] 4-chlorobenzenecarbothioate, S-{2-(4-methoxyphenyl)-4-[(4-methylphenyl)sulfonyl]-1H-imidazol-5-yl} 4-chlorobenzenecarbothioate, 4-chlorophenyl 2-(4-methoxyphenyl)-4-[(4-methylphenyl)sulfonyl]imidazol-5-ylth io ketone
| Molecular Formula | C24H19ClN2O4S2 |
|---|---|
| Molecular Weight | 498.05 g/mol |
| LogP | 5.81242 |
| Topological Polar Surface Area | 89.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 498.0475 |
| Heavy Atoms | 33 |
| Complexity | 1396.612 |
Chemical Identifiers
| CAS Number | 164398-64-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C2=C(N=C(N2)C3=CC=C(C=C3)OC)SC(=O)C4=CC=C(C=C4)Cl |
Product Overview
S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate (CAS 164398-64-5), with molecular formula C24H19ClN2O4S2 and molecular weight 498.05 g/mol. IUPAC: S-[2-(4-methoxyphenyl)-5-(4-methylphenyl)sulfonyl-1H-imidazol-4-yl] 4-chlorobenzenecarbothioate.
Chemical Property Profile of S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate
Property Insights of S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate
The XLogP value of 5.81242 indicates that S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.12 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate. Following Lipinski's Rule of Five, S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate has 1 hydrogen bond donor(s) and 6 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-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate?
The CAS number of S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate is 164398-64-5.
What is the molecular formula of S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate?
The molecular formula of S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate is C24H19ClN2O4S2.
What is the molecular weight of S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate?
The molecular weight of S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate is 498.05 g/mol.
Where can I buy S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate?
You can request a quote for S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate?
Yes, KEHONG BIO provides custom synthesis services for S-(2-(4-methoxyphenyl)-4-tosyl-1H-imidazol-5-yl) 4-chlorobenzothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.