Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]-
TL;DR: Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]- (CAS 87956-84-1) is a chemical compound with molecular formula C10H13NOS2 and molecular weight 227.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-methoxy-4-methylsulfanylphenyl)ethanethioamide
Also Known As: Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]-, N-[3-methoxy-4-(methylsulfanyl)phenyl]ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]ethanethioamide, N-(3-methoxy-4-methylsulfanylphenyl)ethanethioamide, 1-[(3-methoxy-4-methylthiophenyl)amino]ethane-1-thione
| Molecular Formula | C10H13NOS2 |
|---|---|
| Molecular Weight | 227.04 g/mol |
| LogP | 3.1763 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.04385 |
| Heavy Atoms | 14 |
| Complexity | 338.89392 |
Chemical Identifiers
| CAS Number | 87956-84-1 |
|---|---|
| SMILES | CC(=S)NC1=CC(=C(C=C1)SC)OC |
Product Overview
Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]- (CAS 87956-84-1), with molecular formula C10H13NOS2 and molecular weight 227.04 g/mol. IUPAC: N-(3-methoxy-4-methylsulfanylphenyl)ethanethioamide.
Chemical Property Profile of Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]-
Property Insights of Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]-
The XLogP value of 3.1763 indicates that Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.26 Ų, Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]- has 1 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 Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]-?
The CAS number of Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]- is 87956-84-1.
What is the molecular formula of Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]-?
The molecular formula of Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]- is C10H13NOS2.
What is the molecular weight of Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]-?
The molecular weight of Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]- is 227.04 g/mol.
Where can I buy Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]-?
You can request a quote for Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]-?
Yes, KEHONG BIO provides custom synthesis services for Ethanethioamide, N-[3-methoxy-4-(methylthio)phenyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.