![Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate structure](/static/products/3204/320422-84-2.webp)
Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate
TL;DR: Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate (CAS 320422-84-2) is a chemical compound with molecular formula C12H16N2O3S and molecular weight 268.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(4-methoxyphenyl)carbamothioylamino]acetate
Also Known As: ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate, ethyl 2-{[(4-methoxyphenyl)carbamothioyl]amino}acetate, ethyl 2-[(4-methoxyphenyl)carbamothioylamino]acetate, Ethyl ((4-methoxyphenyl)carbamothioyl)glycinate, Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino} acetate
| Molecular Formula | C12H16N2O3S |
|---|---|
| Molecular Weight | 268.09 g/mol |
| LogP | 1.5447 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 268.08817 |
| Heavy Atoms | 18 |
| Complexity | 406.28848 |
Chemical Identifiers
| CAS Number | 320422-84-2 |
|---|---|
| SMILES | CCOC(=O)CNC(=S)NC1=CC=C(C=C1)OC |
Product Overview
Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate (CAS 320422-84-2), with molecular formula C12H16N2O3S and molecular weight 268.09 g/mol. IUPAC: ethyl 2-[(4-methoxyphenyl)carbamothioylamino]acetate.
Chemical Property Profile of Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate
Property Insights of Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate
The XLogP value of 1.5447 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate. With a topological polar surface area (TPSA) of 59.59 Ų, Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate 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 Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate?
The CAS number of Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate is 320422-84-2.
What is the molecular formula of Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate?
The molecular formula of Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate is C12H16N2O3S.
What is the molecular weight of Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate?
The molecular weight of Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate is 268.09 g/mol.
Where can I buy Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate?
You can request a quote for Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-{[(4-methoxyanilino)carbothioyl]amino}acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.