(3,4-Dihydroisoquinolin-2(1H)-yl)(pyrazin-2-yl)methanone

Base Information

• Chemical Name: (3,4-Dihydroisoquinolin-2(1H)-yl)(pyrazin-2-yl)methanone
• CAS No.: 551916-85-9
• Molecular Formula: C14H13N3O
• Molecular Weight: 239.27252
• ChEMBL ID: CHEMBL1421943
• DSSTox Substance ID: DTXSID10404959
• Wikidata: Q82209321
• Mol file: 551916-85-9.mol

Synonyms:551916-85-9;MLS000772826;CHEMBL1421943;(3,4-Dihydroisoquinolin-2(1H)-yl)(pyrazin-2-yl)methanone;DTXSID10404959;HMS2709M15;AKOS003846093;SMR000377451;Z27717221;Isoquinoline,1,2,3,4-tetrahydro-2-(pyrazinylcarbonyl)-(9ci)

Chemical Property of (3,4-Dihydroisoquinolin-2(1H)-yl)(pyrazin-2-yl)methanone

Chemical Property:

• PSA: 46.09000
• LogP: 1.61300
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 239.105862047
• Heavy Atom Count: 18
• Complexity: 307

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CC2=CC=CC=C21)C(=O)C3=NC=CN=C3