4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide
TL;DR: 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide (CAS 896301-23-8) is a chemical compound with molecular formula C18H20N2O2S and molecular weight 328.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide
Also Known As: 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide, F2590-0018
| Molecular Formula | C18H20N2O2S |
|---|---|
| Molecular Weight | 328.12 g/mol |
| LogP | 4.66782 |
| Topological Polar Surface Area | 62.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 328.12454 |
| Heavy Atoms | 23 |
| Complexity | 726.7152 |
Chemical Identifiers
| CAS Number | 896301-23-8 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C(=O)NC2=C(C(=C(S2)C)C)C#N |
Product Overview
4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide (CAS 896301-23-8), with molecular formula C18H20N2O2S and molecular weight 328.12 g/mol. IUPAC: 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide.
Chemical Property Profile of 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide
Property Insights of 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide
The XLogP value of 4.66782 indicates that 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide. Following Lipinski's Rule of Five, 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide has 1 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 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide?
The CAS number of 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide is 896301-23-8.
What is the molecular formula of 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide?
The molecular formula of 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide is C18H20N2O2S.
What is the molecular weight of 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide?
The molecular weight of 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide is 328.12 g/mol.
Where can I buy 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide?
You can request a quote for 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-butoxy-N-(3-cyano-4,5-dimethylthiophen-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.