2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)-
TL;DR: 2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)- (CAS 107788-01-2) is a chemical compound with molecular formula C20H20N2O3S and molecular weight 368.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-[3-ethoxy-4-methoxy-5-(phenylsulfanylmethyl)phenyl]prop-2-enamide
Also Known As: 2-Cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)-2-propenamide, 2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)-, (E)-2-cyano-3-[3-ethoxy-4-methoxy-5-(phenylsulfanylmethyl)phenyl]prop-2-enamide, RefChem:1064454
| Molecular Formula | C20H20N2O3S |
|---|---|
| Molecular Weight | 368.12 g/mol |
| LogP | 3.77848 |
| Topological Polar Surface Area | 85.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 368.11948 |
| Heavy Atoms | 26 |
| Complexity | 842.12506 |
Chemical Identifiers
| CAS Number | 107788-01-2 |
|---|---|
| SMILES | CCOC1=CC(=CC(=C1OC)CSC2=CC=CC=C2)/C=C(\C#N)/C(=O)N |
Product Overview
2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)- (CAS 107788-01-2), with molecular formula C20H20N2O3S and molecular weight 368.12 g/mol. IUPAC: (E)-2-cyano-3-[3-ethoxy-4-methoxy-5-(phenylsulfanylmethyl)phenyl]prop-2-enamide.
Chemical Property Profile of 2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)-
Property Insights of 2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)-
The XLogP value of 3.77848 indicates that 2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)-. Following Lipinski's Rule of Five, 2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)- has 1 hydrogen bond donor(s) and 5 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-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)-?
The CAS number of 2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)- is 107788-01-2.
What is the molecular formula of 2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)-?
The molecular formula of 2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)- is C20H20N2O3S.
What is the molecular weight of 2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)-?
The molecular weight of 2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)- is 368.12 g/mol.
Where can I buy 2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)-?
You can request a quote for 2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenamide, 2-cyano-3-(3-ethoxy-4-methoxy-5-((phenylthio)methyl)phenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.