![2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide structure](/static/products/1164/1164516-98-6.webp)
2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide
TL;DR: 2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide (CAS 1164516-98-6) is a chemical compound with molecular formula C18H16N2OS and molecular weight 308.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-N-(3-methylphenyl)-3-(4-methylsulfanylphenyl)prop-2-enamide
Also Known As: (E)-2-cyano-N-(3-methylphenyl)-3-(4-methylsulfanylphenyl)prop-2-enamide, 2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide
| Molecular Formula | C18H16N2OS |
|---|---|
| Molecular Weight | 308.10 g/mol |
| LogP | 4.2626 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.09833 |
| Heavy Atoms | 22 |
| Complexity | 742.4276 |
Chemical Identifiers
| CAS Number | 1164516-98-6 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=O)/C(=C/C2=CC=C(C=C2)SC)/C#N |
Product Overview
2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide (CAS 1164516-98-6), with molecular formula C18H16N2OS and molecular weight 308.10 g/mol. IUPAC: (E)-2-cyano-N-(3-methylphenyl)-3-(4-methylsulfanylphenyl)prop-2-enamide.
Chemical Property Profile of 2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide
Property Insights of 2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide
The XLogP value of 4.2626 indicates that 2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, 2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide 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 2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide?
The CAS number of 2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide is 1164516-98-6.
What is the molecular formula of 2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide?
The molecular formula of 2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide is C18H16N2OS.
What is the molecular weight of 2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide?
The molecular weight of 2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide is 308.10 g/mol.
Where can I buy 2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide?
You can request a quote for 2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 2-cyano-N-(3-methylphenyl)-3-[4-(methylsulfanyl)phenyl]prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.