4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide
TL;DR: 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide (CAS 78388-19-9) is a chemical compound with molecular formula C12H17NO2S and molecular weight 239.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide
Also Known As: 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide, 4-methyl-N-(3-methyl-2-butenyl)benzenesulfonamide, N-(3-Methyl-2-butenyl)-p-toluenesulfonamide, J1.396.720B, AB-131/42301227
| Molecular Formula | C12H17NO2S |
|---|---|
| Molecular Weight | 239.10 g/mol |
| LogP | 2.23952 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 239.098 |
| Heavy Atoms | 16 |
| Complexity | 468.24515 |
Chemical Identifiers
| CAS Number | 78388-19-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCC=C(C)C |
Product Overview
4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide (CAS 78388-19-9), with molecular formula C12H17NO2S and molecular weight 239.10 g/mol. IUPAC: 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide.
Chemical Property Profile of 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide
Property Insights of 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide
The XLogP value of 2.23952 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide. With a topological polar surface area (TPSA) of 46.17 Ų, 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide 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 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide?
The CAS number of 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide is 78388-19-9.
What is the molecular formula of 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide?
The molecular formula of 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide is C12H17NO2S.
What is the molecular weight of 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide?
The molecular weight of 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide is 239.10 g/mol.
Where can I buy 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide?
You can request a quote for 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-N-(3-methylbut-2-enyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.