N-tert-butyl-2,5-dimethylbenzenesulfonamide
TL;DR: N-tert-butyl-2,5-dimethylbenzenesulfonamide (CAS 876550-09-3) is a chemical compound with molecular formula C12H19NO2S and molecular weight 241.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-2,5-dimethylbenzenesulfonamide
Also Known As: N-tert-butyl-2,5-dimethylbenzenesulfonamide, N-(tert-butyl)-2,5-dimethylbenzenesulfonamide, (tert-butyl)[(2,5-dimethylphenyl)sulfonyl]amine, AP-263/43418272, 2,5-DIMETHYL-N-(2-METHYL-2-PROPANYL)BENZENESULFONAMIDE
| Molecular Formula | C12H19NO2S |
|---|---|
| Molecular Weight | 241.11 g/mol |
| LogP | 2.38024 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 241.11365 |
| Heavy Atoms | 16 |
| Complexity | 484.2305 |
Chemical Identifiers
| CAS Number | 876550-09-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)S(=O)(=O)NC(C)(C)C |
Product Overview
N-tert-butyl-2,5-dimethylbenzenesulfonamide (CAS 876550-09-3), with molecular formula C12H19NO2S and molecular weight 241.11 g/mol. IUPAC: N-tert-butyl-2,5-dimethylbenzenesulfonamide.
Chemical Property Profile of N-tert-butyl-2,5-dimethylbenzenesulfonamide
Property Insights of N-tert-butyl-2,5-dimethylbenzenesulfonamide
The XLogP value of 2.38024 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-tert-butyl-2,5-dimethylbenzenesulfonamide. With a topological polar surface area (TPSA) of 46.17 Ų, N-tert-butyl-2,5-dimethylbenzenesulfonamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-tert-butyl-2,5-dimethylbenzenesulfonamide 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-tert-butyl-2,5-dimethylbenzenesulfonamide?
The CAS number of N-tert-butyl-2,5-dimethylbenzenesulfonamide is 876550-09-3.
What is the molecular formula of N-tert-butyl-2,5-dimethylbenzenesulfonamide?
The molecular formula of N-tert-butyl-2,5-dimethylbenzenesulfonamide is C12H19NO2S.
What is the molecular weight of N-tert-butyl-2,5-dimethylbenzenesulfonamide?
The molecular weight of N-tert-butyl-2,5-dimethylbenzenesulfonamide is 241.11 g/mol.
Where can I buy N-tert-butyl-2,5-dimethylbenzenesulfonamide?
You can request a quote for N-tert-butyl-2,5-dimethylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-tert-butyl-2,5-dimethylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-tert-butyl-2,5-dimethylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.