![S-methyl N-[amino(benzamido)methylidene]carbamothioate structure](/static/products/7934/79340-26-4.webp)
S-methyl N-[amino(benzamido)methylidene]carbamothioate
TL;DR: S-methyl N-[amino(benzamido)methylidene]carbamothioate (CAS 79340-26-4) is a chemical compound with molecular formula C10H11N3O2S and molecular weight 237.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-methyl N-[amino(benzamido)methylidene]carbamothioate
Also Known As: S-methyl N-[amino(benzamido)methylidene]carbamothioate, N-(N-METHYLSULFANYLCARBONYLCARBAMIMIDOYL)BENZAMIDE
| Molecular Formula | C10H11N3O2S |
|---|---|
| Molecular Weight | 237.06 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 237.0572 |
| Heavy Atoms | 16 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 79340-26-4 |
|---|---|
| SMILES | CSC(=O)N=C(N)NC(=O)C1=CC=CC=C1 |
| InChIKey | LJKDNVBJGZRSGN-UHFFFAOYSA-N |
Product Overview
S-methyl N-[amino(benzamido)methylidene]carbamothioate (CAS 79340-26-4), with molecular formula C10H11N3O2S and molecular weight 237.06 g/mol. IUPAC: S-methyl N-[amino(benzamido)methylidene]carbamothioate.
Chemical Property Profile of S-methyl N-[amino(benzamido)methylidene]carbamothioate
Property Insights of S-methyl N-[amino(benzamido)methylidene]carbamothioate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-methyl N-[amino(benzamido)methylidene]carbamothioate. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for S-methyl N-[amino(benzamido)methylidene]carbamothioate. Following Lipinski's Rule of Five, S-methyl N-[amino(benzamido)methylidene]carbamothioate has 2 hydrogen bond donor(s) and 3 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-[amino(benzamido)methylidene]carbamothioate?
The CAS number of S-methyl N-[amino(benzamido)methylidene]carbamothioate is 79340-26-4.
What is the molecular formula of S-methyl N-[amino(benzamido)methylidene]carbamothioate?
The molecular formula of S-methyl N-[amino(benzamido)methylidene]carbamothioate is C10H11N3O2S.
What is the molecular weight of S-methyl N-[amino(benzamido)methylidene]carbamothioate?
The molecular weight of S-methyl N-[amino(benzamido)methylidene]carbamothioate is 237.06 g/mol.
Where can I buy S-methyl N-[amino(benzamido)methylidene]carbamothioate?
You can request a quote for S-methyl N-[amino(benzamido)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-[amino(benzamido)methylidene]carbamothioate?
Yes, KEHONG BIO provides custom synthesis services for S-methyl N-[amino(benzamido)methylidene]carbamothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.