![3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide structure](/static/products/3334/333429-94-0.webp)
3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide
TL;DR: 3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide (CAS 333429-94-0) is a chemical compound with molecular formula C15H16N2O4S and molecular weight 320.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitro-N-(4-propan-2-ylphenyl)benzenesulfonamide
Also Known As: BAS 00407741, 3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide, 3-nitro-N-(4-propan-2-ylphenyl)benzenesulfonamide, N-(4-Isopropyl-phenyl)-3-nitro-benzenesulfonamide
| Molecular Formula | C15H16N2O4S |
|---|---|
| Molecular Weight | 320.08 g/mol |
| LogP | 3.519 |
| Topological Polar Surface Area | 89.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 320.08307 |
| Heavy Atoms | 22 |
| Complexity | 783.4447 |
Chemical Identifiers
| CAS Number | 333429-94-0 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-] |
Product Overview
3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide (CAS 333429-94-0), with molecular formula C15H16N2O4S and molecular weight 320.08 g/mol. IUPAC: 3-nitro-N-(4-propan-2-ylphenyl)benzenesulfonamide.
Chemical Property Profile of 3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide
Property Insights of 3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide
The XLogP value of 3.519 indicates that 3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.31 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide. Following Lipinski's Rule of Five, 3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide has 1 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 3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide?
The CAS number of 3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide is 333429-94-0.
What is the molecular formula of 3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide?
The molecular formula of 3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide is C15H16N2O4S.
What is the molecular weight of 3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide?
The molecular weight of 3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide is 320.08 g/mol.
Where can I buy 3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide?
You can request a quote for 3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 3-nitro-N-[4-(propan-2-yl)phenyl]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.