N-butyl-4-nitro-N-phenylbenzenesulfonamide
TL;DR: N-butyl-4-nitro-N-phenylbenzenesulfonamide (CAS 211675-99-9) is a chemical compound with molecular formula C16H18N2O4S and molecular weight 334.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-4-nitro-N-phenylbenzenesulfonamide
Also Known As: N-butyl-4-nitro-N-phenylbenzenesulfonamide, butyl[(4-nitrophenyl)sulfonyl]phenylamine, N-butyl-4-nitro-N-phenylbenzene-1-sulfonamide, N-Phenyl-N-butyl-4-nitrobenzenesulfonamide, 4-Nitro-benzolsulfonsaeure-(N-aethyl-anilid)
| Molecular Formula | C16H18N2O4S |
|---|---|
| Molecular Weight | 334.10 g/mol |
| LogP | 3.5902 |
| Topological Polar Surface Area | 80.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 334.09872 |
| Heavy Atoms | 23 |
| Complexity | 758.42706 |
Chemical Identifiers
| CAS Number | 211675-99-9 |
|---|---|
| SMILES | CCCCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
N-butyl-4-nitro-N-phenylbenzenesulfonamide (CAS 211675-99-9), with molecular formula C16H18N2O4S and molecular weight 334.10 g/mol. IUPAC: N-butyl-4-nitro-N-phenylbenzenesulfonamide.
Chemical Property Profile of N-butyl-4-nitro-N-phenylbenzenesulfonamide
Property Insights of N-butyl-4-nitro-N-phenylbenzenesulfonamide
The XLogP value of 3.5902 indicates that N-butyl-4-nitro-N-phenylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.52 Ų falls within the moderate polarity range, balancing permeability and solubility for N-butyl-4-nitro-N-phenylbenzenesulfonamide. Following Lipinski's Rule of Five, N-butyl-4-nitro-N-phenylbenzenesulfonamide has 0 hydrogen bond donor(s) and 4 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-4-nitro-N-phenylbenzenesulfonamide?
The CAS number of N-butyl-4-nitro-N-phenylbenzenesulfonamide is 211675-99-9.
What is the molecular formula of N-butyl-4-nitro-N-phenylbenzenesulfonamide?
The molecular formula of N-butyl-4-nitro-N-phenylbenzenesulfonamide is C16H18N2O4S.
What is the molecular weight of N-butyl-4-nitro-N-phenylbenzenesulfonamide?
The molecular weight of N-butyl-4-nitro-N-phenylbenzenesulfonamide is 334.10 g/mol.
Where can I buy N-butyl-4-nitro-N-phenylbenzenesulfonamide?
You can request a quote for N-butyl-4-nitro-N-phenylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butyl-4-nitro-N-phenylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-4-nitro-N-phenylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.