![S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate structure](/static/products/7934/79340-34-4.webp)
S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate
TL;DR: S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate (CAS 79340-34-4) is a chemical compound with molecular formula C11H12N2O2S2 and molecular weight 268.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate
Also Known As: S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate, S-methyl (NZ)-N-[benzamido(methylsulfanyl)methylidene]carbamothioate
| Molecular Formula | C11H12N2O2S2 |
|---|---|
| Molecular Weight | 268.03 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 268.03403 |
| Heavy Atoms | 17 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 79340-34-4 |
|---|---|
| SMILES | CSC(=NC(=O)SC)NC(=O)C1=CC=CC=C1 |
| InChIKey | PGRPOFUVKVPIIM-UHFFFAOYSA-N |
Product Overview
S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate (CAS 79340-34-4), with molecular formula C11H12N2O2S2 and molecular weight 268.03 g/mol. IUPAC: S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate.
Chemical Property Profile of S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate
Property Insights of S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate
The XLogP value of 3.5 indicates that S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate. Following Lipinski's Rule of Five, S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate has 1 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-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate?
The CAS number of S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate is 79340-34-4.
What is the molecular formula of S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate?
The molecular formula of S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate is C11H12N2O2S2.
What is the molecular weight of S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate?
The molecular weight of S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate is 268.03 g/mol.
Where can I buy S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate?
You can request a quote for S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate?
Yes, KEHONG BIO provides custom synthesis services for S-methyl N-[benzamido(methylsulfanyl)methylidene]carbamothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.