4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide
TL;DR: 4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide (CAS 838876-41-8) is a chemical compound with molecular formula C14H18ClN3O2S and molecular weight 327.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide
Also Known As: BAS 11404188, 4-Chloro-N-(3-imidazol-1-yl-propyl)-2,5-dimethyl-benzenesulfonamide, 4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide, A4127/0175979, 4-chloro-N-[3-(1H-imidazol-1-yl)propyl]-2,5-dimethylbenzene-1-sulfonamide
| Molecular Formula | C14H18ClN3O2S |
|---|---|
| Molecular Weight | 327.08 g/mol |
| LogP | 2.52194 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 327.0808 |
| Heavy Atoms | 21 |
| Complexity | 712.0704 |
Chemical Identifiers
| CAS Number | 838876-41-8 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Cl)C)S(=O)(=O)NCCCN2C=CN=C2 |
Product Overview
4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide (CAS 838876-41-8), with molecular formula C14H18ClN3O2S and molecular weight 327.08 g/mol. IUPAC: 4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide.
Chemical Property Profile of 4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide
Property Insights of 4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide
The XLogP value of 2.52194 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide. Following Lipinski's Rule of Five, 4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide 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-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide?
The CAS number of 4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide is 838876-41-8.
What is the molecular formula of 4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide?
The molecular formula of 4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide is C14H18ClN3O2S.
What is the molecular weight of 4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide?
The molecular weight of 4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide is 327.08 g/mol.
Where can I buy 4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide?
You can request a quote for 4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide 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-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-(3-imidazol-1-ylpropyl)-2,5-dimethylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.