N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide
TL;DR: N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide (CAS 81705-04-6) is a chemical compound with molecular formula C14H17ClN2O2S and molecular weight 312.06992 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-aminobutyl)-5-chloronaphthalene-2-sulfonamide
Also Known As: W-13 Hydrochloride, N-(4-aminobutyl)-5-chloronaphthalene-2-sulfonamide, w-13, N-(4-Aminobutyl)-5-Chloro-2-Naphthalenesulfonamide, HSCI1_000322
Application Areas
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H17ClN2O2S |
| Molecular Weight | 312.06992 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 80.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 312.06992 Da |
| Heavy Atoms | 20 |
| Complexity | 396.0 |
| SMILES | C1=CC2=C(C=CC(=C2)S(=O)(=O)NCCCCN)C(=C1)Cl |
| InChIKey | JJQKICOADUKSNS-UHFFFAOYSA-N |
Product Description
Applications: N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide (CAS 81705-04-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide (CAS 81705-04-6) is a heterocyclic building block with the molecular formula C14H17ClN2O2S and a molecular weight of 312.07 g/mol. It is also known as W-13 Hydrochloride and Tocris-0361.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide
Property Insights of N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide. The TPSA of 80.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide. Following Lipinski's Rule of Five, N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide?
The CAS number of N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide is 81705-04-6.
What is the molecular formula of N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide?
The molecular formula of N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide is C14H17ClN2O2S.
What is the molecular weight of N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide?
The molecular weight of N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide is 312.06992 g/mol.
What are the applications of N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide?
N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...
Where can I buy N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide?
You can request a quote for N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide?
Yes, CoreyChem provides custom synthesis services for N-(4-Aminobutyl)-5-chloro-2-naphthalenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.