N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide
TL;DR: N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide (CAS 52078-00-9) is a chemical compound with molecular formula C16H10N4O8S and molecular weight 418.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide
Also Known As: N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide, N-(2,4-Dinitronaphthalen-1-yl)-4-nitrobenzene-1-sulfonamide
| Molecular Formula | C16H10N4O8S |
|---|---|
| Molecular Weight | 418.02 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 192.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 418.02194 |
| Heavy Atoms | 29 |
| Complexity | 745.0 |
Chemical Identifiers
| CAS Number | 52078-00-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC(=C2NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | LDRXPMDFIZFIDJ-UHFFFAOYSA-N |
Product Overview
N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide (CAS 52078-00-9), with molecular formula C16H10N4O8S and molecular weight 418.02 g/mol. IUPAC: N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide.
Chemical Property Profile of N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide
Property Insights of N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide
The XLogP value of 3.7 indicates that N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 192.0 Ų indicates high polarity, suggesting N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide has 1 hydrogen bond donor(s) and 9 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-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide?
The CAS number of N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide is 52078-00-9.
What is the molecular formula of N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide?
The molecular formula of N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide is C16H10N4O8S.
What is the molecular weight of N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide?
The molecular weight of N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide is 418.02 g/mol.
Where can I buy N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide?
You can request a quote for N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,4-dinitronaphthalen-1-yl)-4-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.