1H-Imidazo(4,5-c)pyridin-4-amine, 1-(5-S-(2-methylpropyl)-5-thio-beta-D-ribofuranosyl)-

Base Information

• Chemical Name: 1H-Imidazo(4,5-c)pyridin-4-amine, 1-(5-S-(2-methylpropyl)-5-thio-beta-D-ribofuranosyl)-
• CAS No.: 67377-76-8
• Molecular Formula: C15H22N4O3S
• Molecular Weight: 338.43
• Mol file: 67377-76-8.mol

Synonyms:3-deaza-SIBA;5'-deoxy-5'-(isobutylthio)-3-deazaadenosine;S-isobutyryl-3-deaza-adenosine;S-isobutyryl-3-deazaadenosine

Chemical Property of 1H-Imidazo(4,5-c)pyridin-4-amine, 1-(5-S-(2-methylpropyl)-5-thio-beta-D-ribofuranosyl)-

Chemical Property:

• Vapor Pressure: 1.3E-16mmHg at 25°C
• Boiling Point: 627.5°C at 760 mmHg
• Flash Point: 333.3°C
• PSA: 131.72000
• Density: 1.54g/cm³
• LogP: 1.60310
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 5
• Exact Mass: 338.14126175
• Heavy Atom Count: 23
• Complexity: 403

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CSCC1C(C(C(O1)N2C=NC3=C2C=CN=C3N)O)O
• Isomeric SMILES: CC(C)CSC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C2C=CN=C3N)O)O