N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide
TL;DR: N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide (CAS 329218-94-2) is a chemical compound with molecular formula C17H18N2OS and molecular weight 298.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide
Also Known As: N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide, AB01327075-02, N-(3-cyano-4,5-dimethyl-2-thienyl)-2-phenylbutanamide, N-(3-cyano-4,5-dimethyl(2-thienyl))-2-phenylbutanamide
| Molecular Formula | C17H18N2OS |
|---|---|
| Molecular Weight | 298.11 g/mol |
| LogP | 4.36892 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 298.11398 |
| Heavy Atoms | 21 |
| Complexity | 682.8059 |
Chemical Identifiers
| CAS Number | 329218-94-2 |
|---|---|
| SMILES | CCC(C1=CC=CC=C1)C(=O)NC2=C(C(=C(S2)C)C)C#N |
Product Overview
N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide (CAS 329218-94-2), with molecular formula C17H18N2OS and molecular weight 298.11 g/mol. IUPAC: N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide.
Chemical Property Profile of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide
Property Insights of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide
The XLogP value of 4.36892 indicates that N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide 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)-2-phenylbutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide 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)-2-phenylbutanamide?
The CAS number of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide is 329218-94-2.
What is the molecular formula of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide?
The molecular formula of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide is C17H18N2OS.
What is the molecular weight of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide?
The molecular weight of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide is 298.11 g/mol.
Where can I buy N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide?
You can request a quote for N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide 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)-2-phenylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-phenylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.