N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide
TL;DR: N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide (CAS 873579-62-5) 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.
N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide
Also Known As: N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide, N-benzyl-3,4-dimethyl-5-nitrobenzene-1-sulfonamide, VU0606901-1, F3237-0660, [(4,5-dimethyl-3-nitrophenyl)sulfonyl]benzylamine
| Molecular Formula | C15H16N2O4S |
|---|---|
| Molecular Weight | 320.08 g/mol |
| LogP | 2.69014 |
| 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 | 801.7922 |
Chemical Identifiers
| CAS Number | 873579-62-5 |
|---|---|
| SMILES | CC1=CC(=CC(=C1C)[N+](=O)[O-])S(=O)(=O)NCC2=CC=CC=C2 |
Product Overview
N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide (CAS 873579-62-5), with molecular formula C15H16N2O4S and molecular weight 320.08 g/mol. IUPAC: N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide.
Chemical Property Profile of N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide
Property Insights of N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide
The XLogP value of 2.69014 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide. The TPSA of 89.31 Ų falls within the moderate polarity range, balancing permeability and solubility for N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide 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 N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide?
The CAS number of N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide is 873579-62-5.
What is the molecular formula of N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide?
The molecular formula of N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide is C15H16N2O4S.
What is the molecular weight of N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide?
The molecular weight of N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide is 320.08 g/mol.
Where can I buy N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide?
You can request a quote for N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-3,4-dimethyl-5-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.