![4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide structure](/static/products/6949/6949-48-0.webp)
4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide
TL;DR: 4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide (CAS 6949-48-0) is a chemical compound with molecular formula C16H17N3O4S and molecular weight 347.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide
Also Known As: 4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide, Benzenesulfonic acid,4-nitro-, 2-[[4-(1-methylethyl)phenyl]methylene]hydrazide
| Molecular Formula | C16H17N3O4S |
|---|---|
| Molecular Weight | 347.09 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 347.09396 |
| Heavy Atoms | 24 |
| Complexity | 535.0 |
Chemical Identifiers
| CAS Number | 6949-48-0 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C=NNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | GSMSEEVPELPKCU-UHFFFAOYSA-N |
Product Overview
4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide (CAS 6949-48-0), with molecular formula C16H17N3O4S and molecular weight 347.09 g/mol. IUPAC: 4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide.
Chemical Property Profile of 4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide
Property Insights of 4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide
The XLogP value of 3.5 indicates that 4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide. Following Lipinski's Rule of Five, 4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide 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-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide?
The CAS number of 4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide is 6949-48-0.
What is the molecular formula of 4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide?
The molecular formula of 4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide is C16H17N3O4S.
What is the molecular weight of 4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide?
The molecular weight of 4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide is 347.09 g/mol.
Where can I buy 4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide?
You can request a quote for 4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide 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-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-nitro-N-[(4-propan-2-ylphenyl)methylideneamino]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.