N-(4-ethynylphenyl)thiophene-2-carboxamide
TL;DR: N-(4-ethynylphenyl)thiophene-2-carboxamide (CAS 439095-49-5) is a chemical compound with molecular formula C13H9NOS and molecular weight 227.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-ethynylphenyl)thiophene-2-carboxamide
Also Known As: N-(4-ethynylphenyl)thiophene-2-carboxamide, N-(4-ethynylphenyl)-2-thiophenecarboxamide, thiophene-2-carboxylic acid (4-ethynyl-phenyl)-amide
| Molecular Formula | C13H9NOS |
|---|---|
| Molecular Weight | 227.04 g/mol |
| LogP | 2.9817 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.04048 |
| Heavy Atoms | 16 |
| Complexity | 520.0603 |
Chemical Identifiers
| CAS Number | 439095-49-5 |
|---|---|
| SMILES | C#CC1=CC=C(C=C1)NC(=O)C2=CC=CS2 |
Product Overview
N-(4-ethynylphenyl)thiophene-2-carboxamide (CAS 439095-49-5), with molecular formula C13H9NOS and molecular weight 227.04 g/mol. IUPAC: N-(4-ethynylphenyl)thiophene-2-carboxamide.
Chemical Property Profile of N-(4-ethynylphenyl)thiophene-2-carboxamide
Property Insights of N-(4-ethynylphenyl)thiophene-2-carboxamide
The XLogP value of 2.9817 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-ethynylphenyl)thiophene-2-carboxamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-(4-ethynylphenyl)thiophene-2-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-ethynylphenyl)thiophene-2-carboxamide has 1 hydrogen bond donor(s) and 2 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-(4-ethynylphenyl)thiophene-2-carboxamide?
The CAS number of N-(4-ethynylphenyl)thiophene-2-carboxamide is 439095-49-5.
What is the molecular formula of N-(4-ethynylphenyl)thiophene-2-carboxamide?
The molecular formula of N-(4-ethynylphenyl)thiophene-2-carboxamide is C13H9NOS.
What is the molecular weight of N-(4-ethynylphenyl)thiophene-2-carboxamide?
The molecular weight of N-(4-ethynylphenyl)thiophene-2-carboxamide is 227.04 g/mol.
Where can I buy N-(4-ethynylphenyl)thiophene-2-carboxamide?
You can request a quote for N-(4-ethynylphenyl)thiophene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-ethynylphenyl)thiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-ethynylphenyl)thiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.