![4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide structure](/static/products/4000/400085-75-8.webp)
4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide
TL;DR: 4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide (CAS 400085-75-8) is a chemical compound with molecular formula C16H14ClN3O2S and molecular weight 347.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-[(2-imidazol-1-ylphenyl)methyl]benzenesulfonamide
Also Known As: 4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide, 7B-014, 4-chloro-N-[(2-imidazol-1-ylphenyl)methyl]benzenesulfonamide, 4-chloro-N-{[2-(1H-imidazol-1-yl)phenyl]methyl}benzene-1-sulfonamide
| Molecular Formula | C16H14ClN3O2S |
|---|---|
| Molecular Weight | 347.05 g/mol |
| LogP | 3.0042 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 347.04953 |
| Heavy Atoms | 23 |
| Complexity | 891.3395 |
Chemical Identifiers
| CAS Number | 400085-75-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CNS(=O)(=O)C2=CC=C(C=C2)Cl)N3C=CN=C3 |
Product Overview
4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide (CAS 400085-75-8), with molecular formula C16H14ClN3O2S and molecular weight 347.05 g/mol. IUPAC: 4-chloro-N-[(2-imidazol-1-ylphenyl)methyl]benzenesulfonamide.
Chemical Property Profile of 4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide
Property Insights of 4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide
The XLogP value of 3.0042 indicates that 4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide. Following Lipinski's Rule of Five, 4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide has 1 hydrogen bond donor(s) and 3 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-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide?
The CAS number of 4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide is 400085-75-8.
What is the molecular formula of 4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide?
The molecular formula of 4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide is C16H14ClN3O2S.
What is the molecular weight of 4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide?
The molecular weight of 4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide is 347.05 g/mol.
Where can I buy 4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide?
You can request a quote for 4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-[2-(1H-imidazol-1-yl)benzyl]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.