![S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate structure](/static/products/3522/352212-91-0.webp)
S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate
TL;DR: S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate (CAS 352212-91-0) is a chemical compound with molecular formula C11H14N2O2S and molecular weight 238.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-[2-(2,4-dimethylanilino)-2-oxoethyl] carbamothioate
Also Known As: BIM-0013089.P001, S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate, S-[2-(2,4-dimethylanilino)-2-oxoethyl] carbamothioate, S-(2-((2,4-dimethylphenyl)amino)-2-oxoethyl) carbamothioate
| Molecular Formula | C11H14N2O2S |
|---|---|
| Molecular Weight | 238.08 g/mol |
| LogP | 2.05384 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.0776 |
| Heavy Atoms | 16 |
| Complexity | 418.44562 |
Chemical Identifiers
| CAS Number | 352212-91-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=O)CSC(=O)N)C |
Product Overview
S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate (CAS 352212-91-0), with molecular formula C11H14N2O2S and molecular weight 238.08 g/mol. IUPAC: S-[2-(2,4-dimethylanilino)-2-oxoethyl] carbamothioate.
Chemical Property Profile of S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate
Property Insights of S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate
The XLogP value of 2.05384 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate. Following Lipinski's Rule of Five, S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate 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-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate?
The CAS number of S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate is 352212-91-0.
What is the molecular formula of S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate?
The molecular formula of S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate is C11H14N2O2S.
What is the molecular weight of S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate?
The molecular weight of S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate is 238.08 g/mol.
Where can I buy S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate?
You can request a quote for S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate?
Yes, KEHONG BIO provides custom synthesis services for S-[2-(2,4-dimethylanilino)-2-oxoethyl] thiocarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.