![S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate structure](/static/products/3217/321729-51-5.webp)
S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate
TL;DR: S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate (CAS 321729-51-5) is a chemical compound with molecular formula C16H16ClN3O3S2 and molecular weight 397.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate
Also Known As: S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate, (Z)-2-(carbamoylsulfanyl)-N'-(4-chlorobenzenesulfonyl)-N-(4-methylphenyl)ethanimidamide, (Z)-S-(2-(((4-chlorophenyl)sulfonyl)imino)-2-(p-tolylamino)ethyl) carbamothioate
| Molecular Formula | C16H16ClN3O3S2 |
|---|---|
| Molecular Weight | 397.03 g/mol |
| LogP | 3.65962 |
| Topological Polar Surface Area | 101.62 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 397.03217 |
| Heavy Atoms | 25 |
| Complexity | 879.8459 |
Chemical Identifiers
| CAS Number | 321729-51-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=NS(=O)(=O)C2=CC=C(C=C2)Cl)CSC(=O)N |
Product Overview
S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate (CAS 321729-51-5), with molecular formula C16H16ClN3O3S2 and molecular weight 397.03 g/mol. IUPAC: S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate.
Chemical Property Profile of S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate
Property Insights of S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate
The XLogP value of 3.65962 indicates that S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.62 Ų falls within the moderate polarity range, balancing permeability and solubility for S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate. Following Lipinski's Rule of Five, S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate has 2 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 S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate?
The CAS number of S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate is 321729-51-5.
What is the molecular formula of S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate?
The molecular formula of S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate is C16H16ClN3O3S2.
What is the molecular weight of S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate?
The molecular weight of S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate is 397.03 g/mol.
Where can I buy S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate?
You can request a quote for S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate 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-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate?
Yes, KEHONG BIO provides custom synthesis services for S-[2-(4-chlorophenyl)sulfonylimino-2-(4-methylanilino)ethyl] carbamothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.