Adenosine, N-(2-(5-methoxy-1H-indol-3-yl)ethyl)-

Base Information

• Chemical Name: Adenosine, N-(2-(5-methoxy-1H-indol-3-yl)ethyl)-
• CAS No.: 42188-41-0
• Molecular Formula: C21H24N6O5
• Molecular Weight: 440.4525
• DSSTox Substance ID: DTXSID40195005
• Wikidata: Q76150405
• Mol file: 42188-41-0.mol

Synonyms:N-(2-(5-Methoxy-1H-indol-3-yl)ethyl)adenosine;Adenosine, N-(2-(5-methoxy-1H-indol-3-yl)ethyl)-;N(sup 6)-(beta-(5-Methoxy-indolyl-3)-ethyl)adenosine;42188-41-0;DTXSID40195005;LS-15152

Chemical Property of Adenosine, N-(2-(5-methoxy-1H-indol-3-yl)ethyl)-

Chemical Property:

• Vapor Pressure: 2.78E-30mmHg at 25°C
• Boiling Point: 844.2°Cat760mmHg
• Flash Point: 464.4°C
• Density: 1.65g/cm³
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 7
• Exact Mass: 440.18081789
• Heavy Atom Count: 32
• Complexity: 634

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC2=C(C=C1)NC=C2CCNC3=C4C(=NC=N3)N(C=N4)C5C(C(C(O5)CO)O)O
• Isomeric SMILES: COC1=CC2=C(C=C1)NC=C2CCNC3=C4C(=NC=N3)N(C=N4)[C@H]5[C@@H]([C@@H]([C@H](O5)CO)O)O