N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide
TL;DR: N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide (CAS 24118-70-5) is a chemical compound with molecular formula C13H21NO2S and molecular weight 255.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-[(2R)-4-methylpentan-2-yl]benzenesulfonamide
Also Known As: N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide, AN-652/11402315, 4-methyl-N-[(2R)-4-methylpentan-2-yl]benzenesulfonamide, (+)-N-[(R)-1,3-Dimethylbutyl]-p-toluenesulfonamide, 4-methyl-N-[(2R)-4-methylpentan-2-yl]benzene-1-sulfonamide
| Molecular Formula | C13H21NO2S |
|---|---|
| Molecular Weight | 255.13 g/mol |
| LogP | 2.70792 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 255.1293 |
| Heavy Atoms | 17 |
| Complexity | 448.81274 |
Chemical Identifiers
| CAS Number | 24118-70-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N[C@H](C)CC(C)C |
Product Overview
N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide (CAS 24118-70-5), with molecular formula C13H21NO2S and molecular weight 255.13 g/mol. IUPAC: 4-methyl-N-[(2R)-4-methylpentan-2-yl]benzenesulfonamide.
Chemical Property Profile of N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide
Property Insights of N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide
The XLogP value of 2.70792 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide. With a topological polar surface area (TPSA) of 46.17 Ų, N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide 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-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide?
The CAS number of N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide is 24118-70-5.
What is the molecular formula of N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide?
The molecular formula of N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide is C13H21NO2S.
What is the molecular weight of N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide?
The molecular weight of N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide is 255.13 g/mol.
Where can I buy N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide?
You can request a quote for N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-dimethylbutyl)-4-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.