![2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide structure](/static/products/685/685845-20-9.png)
2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide
TL;DR: 2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide (CAS 685845-20-9) is a chemical compound with molecular formula C12H16N2O2S and molecular weight 252.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-ethylanilino)-2-oxoethyl]sulfanylacetamide
Also Known As: 2-[2-(4-ethylanilino)-2-oxoethyl]sulfanylacetamide, 2-[(2-amino-2-oxoethyl)sulfanyl]-N-(4-ethylphenyl)acetamide, AP-906/42087214, 2-(carbamoylmethylthio)-N-(4-ethylphenyl)acetamide
| Molecular Formula | C12H16N2O2S |
|---|---|
| Molecular Weight | 252.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 97.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 252.09325 |
| Heavy Atoms | 17 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 685845-20-9 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)NC(=O)CSCC(=O)N |
| InChIKey | CVDXHZCFLSHSHL-UHFFFAOYSA-N |
Product Overview
2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide (CAS 685845-20-9), with molecular formula C12H16N2O2S and molecular weight 252.09 g/mol. IUPAC: 2-[2-(4-ethylanilino)-2-oxoethyl]sulfanylacetamide.
Chemical Property Profile of 2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide
Property Insights of 2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide. The TPSA of 97.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide. Following Lipinski's Rule of Five, 2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide 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 2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide?
The CAS number of 2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide is 685845-20-9.
What is the molecular formula of 2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide?
The molecular formula of 2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide is C12H16N2O2S.
What is the molecular weight of 2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide?
The molecular weight of 2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide is 252.09 g/mol.
Where can I buy 2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide?
You can request a quote for 2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(4-Ethylanilino)-2-oxoethyl]sulfanylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.