N-butan-2-yl-4-methylsulfanylbenzenesulfonamide
TL;DR: N-butan-2-yl-4-methylsulfanylbenzenesulfonamide (CAS 717893-76-0) is a chemical compound with molecular formula C11H17NO2S2 and molecular weight 259.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butan-2-yl-4-methylsulfanylbenzenesulfonamide
Also Known As: N-butan-2-yl-4-methylsulfanylbenzenesulfonamide, N-(butan-2-yl)-4-(methylsulfanyl)benzenesulfonamide
| Molecular Formula | C11H17NO2S2 |
|---|---|
| Molecular Weight | 259.07 g/mol |
| LogP | 2.4853 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 259.07007 |
| Heavy Atoms | 16 |
| Complexity | 425.8027 |
Chemical Identifiers
| CAS Number | 717893-76-0 |
|---|---|
| SMILES | CCC(C)NS(=O)(=O)C1=CC=C(C=C1)SC |
Product Overview
N-butan-2-yl-4-methylsulfanylbenzenesulfonamide (CAS 717893-76-0), with molecular formula C11H17NO2S2 and molecular weight 259.07 g/mol. IUPAC: N-butan-2-yl-4-methylsulfanylbenzenesulfonamide.
Chemical Property Profile of N-butan-2-yl-4-methylsulfanylbenzenesulfonamide
Property Insights of N-butan-2-yl-4-methylsulfanylbenzenesulfonamide
The XLogP value of 2.4853 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-butan-2-yl-4-methylsulfanylbenzenesulfonamide. With a topological polar surface area (TPSA) of 46.17 Ų, N-butan-2-yl-4-methylsulfanylbenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-butan-2-yl-4-methylsulfanylbenzenesulfonamide 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-butan-2-yl-4-methylsulfanylbenzenesulfonamide?
The CAS number of N-butan-2-yl-4-methylsulfanylbenzenesulfonamide is 717893-76-0.
What is the molecular formula of N-butan-2-yl-4-methylsulfanylbenzenesulfonamide?
The molecular formula of N-butan-2-yl-4-methylsulfanylbenzenesulfonamide is C11H17NO2S2.
What is the molecular weight of N-butan-2-yl-4-methylsulfanylbenzenesulfonamide?
The molecular weight of N-butan-2-yl-4-methylsulfanylbenzenesulfonamide is 259.07 g/mol.
Where can I buy N-butan-2-yl-4-methylsulfanylbenzenesulfonamide?
You can request a quote for N-butan-2-yl-4-methylsulfanylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butan-2-yl-4-methylsulfanylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-butan-2-yl-4-methylsulfanylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.