4-nitro-N-phenylmethoxybenzenesulfinamide
TL;DR: 4-nitro-N-phenylmethoxybenzenesulfinamide (CAS 42860-55-9) is a chemical compound with molecular formula C13H12N2O4S and molecular weight 292.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-N-phenylmethoxybenzenesulfinamide
Also Known As: 4-nitro-N-phenylmethoxybenzenesulfinamide, N-(Benzyloxy)-4-nitrobenzene-1-sulfinamide
| Molecular Formula | C13H12N2O4S |
|---|---|
| Molecular Weight | 292.05 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 292.0518 |
| Heavy Atoms | 20 |
| Complexity | 334.0 |
Chemical Identifiers
| CAS Number | 42860-55-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CONS(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | IPPLFAZUPUXLKL-UHFFFAOYSA-N |
Product Overview
4-nitro-N-phenylmethoxybenzenesulfinamide (CAS 42860-55-9), with molecular formula C13H12N2O4S and molecular weight 292.05 g/mol. IUPAC: 4-nitro-N-phenylmethoxybenzenesulfinamide.
Chemical Property Profile of 4-nitro-N-phenylmethoxybenzenesulfinamide
Property Insights of 4-nitro-N-phenylmethoxybenzenesulfinamide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-nitro-N-phenylmethoxybenzenesulfinamide. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-nitro-N-phenylmethoxybenzenesulfinamide. Following Lipinski's Rule of Five, 4-nitro-N-phenylmethoxybenzenesulfinamide has 1 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 4-nitro-N-phenylmethoxybenzenesulfinamide?
The CAS number of 4-nitro-N-phenylmethoxybenzenesulfinamide is 42860-55-9.
What is the molecular formula of 4-nitro-N-phenylmethoxybenzenesulfinamide?
The molecular formula of 4-nitro-N-phenylmethoxybenzenesulfinamide is C13H12N2O4S.
What is the molecular weight of 4-nitro-N-phenylmethoxybenzenesulfinamide?
The molecular weight of 4-nitro-N-phenylmethoxybenzenesulfinamide is 292.05 g/mol.
Where can I buy 4-nitro-N-phenylmethoxybenzenesulfinamide?
You can request a quote for 4-nitro-N-phenylmethoxybenzenesulfinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-nitro-N-phenylmethoxybenzenesulfinamide?
Yes, KEHONG BIO provides custom synthesis services for 4-nitro-N-phenylmethoxybenzenesulfinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.