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N-[4-(2-phenylethynyl)phenyl]methanesulfonamide
TL;DR: N-[4-(2-phenylethynyl)phenyl]methanesulfonamide (CAS 439095-76-8) is a chemical compound with molecular formula C15H13NO2S and molecular weight 271.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(2-phenylethynyl)phenyl]methanesulfonamide
Also Known As: N-[4-(2-phenylethynyl)phenyl]methanesulfonamide, 1T-1166
| Molecular Formula | C15H13NO2S |
|---|---|
| Molecular Weight | 271.07 g/mol |
| LogP | 2.4579 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 271.0667 |
| Heavy Atoms | 19 |
| Complexity | 708.236 |
Chemical Identifiers
| CAS Number | 439095-76-8 |
|---|---|
| SMILES | CS(=O)(=O)NC1=CC=C(C=C1)C#CC2=CC=CC=C2 |
Product Overview
N-[4-(2-phenylethynyl)phenyl]methanesulfonamide (CAS 439095-76-8), with molecular formula C15H13NO2S and molecular weight 271.07 g/mol. IUPAC: N-[4-(2-phenylethynyl)phenyl]methanesulfonamide.
Chemical Property Profile of N-[4-(2-phenylethynyl)phenyl]methanesulfonamide
Property Insights of N-[4-(2-phenylethynyl)phenyl]methanesulfonamide
The XLogP value of 2.4579 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[4-(2-phenylethynyl)phenyl]methanesulfonamide. With a topological polar surface area (TPSA) of 46.17 Ų, N-[4-(2-phenylethynyl)phenyl]methanesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[4-(2-phenylethynyl)phenyl]methanesulfonamide 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-(2-phenylethynyl)phenyl]methanesulfonamide?
The CAS number of N-[4-(2-phenylethynyl)phenyl]methanesulfonamide is 439095-76-8.
What is the molecular formula of N-[4-(2-phenylethynyl)phenyl]methanesulfonamide?
The molecular formula of N-[4-(2-phenylethynyl)phenyl]methanesulfonamide is C15H13NO2S.
What is the molecular weight of N-[4-(2-phenylethynyl)phenyl]methanesulfonamide?
The molecular weight of N-[4-(2-phenylethynyl)phenyl]methanesulfonamide is 271.07 g/mol.
Where can I buy N-[4-(2-phenylethynyl)phenyl]methanesulfonamide?
You can request a quote for N-[4-(2-phenylethynyl)phenyl]methanesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(2-phenylethynyl)phenyl]methanesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(2-phenylethynyl)phenyl]methanesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.