4-bromo-N-(pyridin-2-ylmethyl)naphthalene-1-sulfonamide

Base Information

• Chemical Name: 4-bromo-N-(pyridin-2-ylmethyl)naphthalene-1-sulfonamide
• CAS No.: 419538-69-5
• Molecular Formula: C16H13BrN2O2S
• Molecular Weight: 377.25562
• European Community (EC) Number: 687-001-5
• UNII: L9PM5Q6DDW
• DSSTox Substance ID: DTXSID80360553
• Nikkaji Number: J2.728.646A
• Wikipedia: Pyrabactin
• Wikidata: Q7263203
• Metabolomics Workbench ID: 66284
• ChEMBL ID: CHEMBL1235543
• Mol file: 419538-69-5.mol

Synonyms:pyrabactin

Chemical Property of 4-bromo-N-(pyridin-2-ylmethyl)naphthalene-1-sulfonamide

Chemical Property:

• PSA: 67.44000
• LogP: 4.94750
• Storage Temp.: room temp
• Solubility.: DMSO: >10mg/mL
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 375.98811
• Heavy Atom Count: 22
• Complexity: 465

Purity/Quality:

98%,99%, ^*data from raw suppliers

Pyrabactin ≥98% (HPLC) ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22-36
• Safety Statements: 26-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=CC=C2Br)S(=O)(=O)NCC3=CC=CC=N3
• Uses: Pyrabactin has been used to form a homogeneous complex of PYL3?pyrabactin for the protein purification by size-exclusion chromatography.

Technology Process of 4-bromo-N-(pyridin-2-ylmethyl)naphthalene-1-sulfonamide

There total 1 articles about 4-bromo-N-(pyridin-2-ylmethyl)naphthalene-1-sulfonamide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ pyrabactin (419538-69-5)

Guidance literature:

Refernces