N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide
TL;DR: N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide (CAS 540529-44-0) is a chemical compound with molecular formula C16H14N2OS and molecular weight 282.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-phenylprop-2-enamide
Also Known As: N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide, (2E)-N-(3-CYANO-4,5-DIMETHYLTHIOPHEN-2-YL)-3-PHENYLPROP-2-ENAMIDE, F2590-0017, (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-phenylprop-2-enamide
| Molecular Formula | C16H14N2OS |
|---|---|
| Molecular Weight | 282.08 g/mol |
| LogP | 3.88852 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.08267 |
| Heavy Atoms | 20 |
| Complexity | 693.2572 |
Chemical Identifiers
| CAS Number | 540529-44-0 |
|---|---|
| SMILES | CC1=C(SC(=C1C#N)NC(=O)/C=C/C2=CC=CC=C2)C |
Product Overview
N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide (CAS 540529-44-0), with molecular formula C16H14N2OS and molecular weight 282.08 g/mol. IUPAC: (E)-N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-phenylprop-2-enamide.
Chemical Property Profile of N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide
Property Insights of N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide
The XLogP value of 3.88852 indicates that N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide 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 N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide?
The CAS number of N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide is 540529-44-0.
What is the molecular formula of N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide?
The molecular formula of N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide is C16H14N2OS.
What is the molecular weight of N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide?
The molecular weight of N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide is 282.08 g/mol.
Where can I buy N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide?
You can request a quote for N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-cyano-4,5-dimethylthiophen-2-yl)cinnamamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.