N-butyl-1-phenylmethanesulfonamide
TL;DR: N-butyl-1-phenylmethanesulfonamide (CAS 69688-96-6) is a chemical compound with molecular formula C11H17NO2S and molecular weight 227.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-1-phenylmethanesulfonamide
Also Known As: N-butyl-1-phenylmethanesulfonamide, N-butyl-benzylsulfonamide, butyl[benzylsulfonyl]amine, N-butyl(phenyl)methanesulfonamide, N-Butylbenzenemethanesulfonamide
| Molecular Formula | C11H17NO2S |
|---|---|
| Molecular Weight | 227.10 g/mol |
| LogP | 1.9061 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 227.098 |
| Heavy Atoms | 15 |
| Complexity | 372.8342 |
Chemical Identifiers
| CAS Number | 69688-96-6 |
|---|---|
| SMILES | CCCCNS(=O)(=O)CC1=CC=CC=C1 |
Product Overview
N-butyl-1-phenylmethanesulfonamide (CAS 69688-96-6), with molecular formula C11H17NO2S and molecular weight 227.10 g/mol. IUPAC: N-butyl-1-phenylmethanesulfonamide.
Chemical Property Profile of N-butyl-1-phenylmethanesulfonamide
Property Insights of N-butyl-1-phenylmethanesulfonamide
The XLogP value of 1.9061 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-butyl-1-phenylmethanesulfonamide. With a topological polar surface area (TPSA) of 46.17 Ų, N-butyl-1-phenylmethanesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-butyl-1-phenylmethanesulfonamide 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-butyl-1-phenylmethanesulfonamide?
The CAS number of N-butyl-1-phenylmethanesulfonamide is 69688-96-6.
What is the molecular formula of N-butyl-1-phenylmethanesulfonamide?
The molecular formula of N-butyl-1-phenylmethanesulfonamide is C11H17NO2S.
What is the molecular weight of N-butyl-1-phenylmethanesulfonamide?
The molecular weight of N-butyl-1-phenylmethanesulfonamide is 227.10 g/mol.
Where can I buy N-butyl-1-phenylmethanesulfonamide?
You can request a quote for N-butyl-1-phenylmethanesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butyl-1-phenylmethanesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-1-phenylmethanesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.