4-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide
TL;DR: 4-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide (CAS 38880-69-2) is a chemical compound with molecular formula C16H18N2O5S and molecular weight 350.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-butan-2-yl-N-(2-hydroxy-4-nitrophenyl)benzenesulfonamide
Also Known As: 4-(SEC-BUTYL)-2'-HYDROXY-4'-NITROBENZENESULFONANILIDE, 4-butan-2-yl-N-(2-hydroxy-4-nitrophenyl)benzenesulfonamide, 4-butan-2-yl-N-(2-hydroxy-4-nitro-phenyl)benzenesulfonamide, 653-427-5, RefChem:516922
| Molecular Formula | C16H18N2O5S |
|---|---|
| Molecular Weight | 350.09 g/mol |
| LogP | 3.6147 |
| Topological Polar Surface Area | 109.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 350.09363 |
| Heavy Atoms | 24 |
| Complexity | 847.27155 |
Chemical Identifiers
| CAS Number | 38880-69-2 |
|---|---|
| SMILES | CCC(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O |
Product Overview
4-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide (CAS 38880-69-2), with molecular formula C16H18N2O5S and molecular weight 350.09 g/mol. IUPAC: 4-butan-2-yl-N-(2-hydroxy-4-nitrophenyl)benzenesulfonamide.
Chemical Property Profile of 4-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide
Property Insights of 4-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide
The XLogP value of 3.6147 indicates that 4-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide. Following Lipinski's Rule of Five, 4-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide has 2 hydrogen bond donor(s) and 5 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-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide?
The CAS number of 4-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide is 38880-69-2.
What is the molecular formula of 4-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide?
The molecular formula of 4-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide is C16H18N2O5S.
What is the molecular weight of 4-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide?
The molecular weight of 4-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide is 350.09 g/mol.
Where can I buy 4-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide?
You can request a quote for 4-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide?
Yes, KEHONG BIO provides custom synthesis services for 4-(Sec-butyl)-2'-hydroxy-4'-nitrobenzenesulfonanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.