Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)-
TL;DR: Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)- (CAS 70660-56-9) is a chemical compound with molecular formula C16H19N3O4S and molecular weight 349.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-anilino-N-butyl-3-nitrobenzenesulfonamide
Also Known As: Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)-, 4-anilino-n-butyl-3-nitrobenzenesulfonamide, 4-Anilino-N-butyl-3-nitrobenzenesulphonamide, 4-Anilino-N-butyl-3-nitrobenzene-1-sulfonamide, Benzenesulfonamide,N-butyl-3-nitro-4-(phenylamino)-
| Molecular Formula | C16H19N3O4S |
|---|---|
| Molecular Weight | 349.11 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 349.10962 |
| Heavy Atoms | 24 |
| Complexity | 494.0 |
Chemical Identifiers
| CAS Number | 70660-56-9 |
|---|---|
| SMILES | CCCCNS(=O)(=O)C1=CC(=C(C=C1)NC2=CC=CC=C2)[N+](=O)[O-] |
| InChIKey | QXBHALGSANZZJB-UHFFFAOYSA-N |
Product Overview
Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)- (CAS 70660-56-9), with molecular formula C16H19N3O4S and molecular weight 349.11 g/mol. IUPAC: 4-anilino-N-butyl-3-nitrobenzenesulfonamide.
Chemical Property Profile of Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)-
Property Insights of Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)-
The XLogP value of 4.1 indicates that Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)-. Following Lipinski's Rule of Five, Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)- has 2 hydrogen bond donor(s) and 6 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 Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)-?
The CAS number of Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)- is 70660-56-9.
What is the molecular formula of Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)-?
The molecular formula of Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)- is C16H19N3O4S.
What is the molecular weight of Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)-?
The molecular weight of Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)- is 349.11 g/mol.
Where can I buy Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)-?
You can request a quote for Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonamide, N-butyl-3-nitro-4-(phenylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.