6-Amino-5-(1H-indol-3-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one

Base Information

• Chemical Name: 6-Amino-5-(1H-indol-3-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
• CAS No.: 61934-43-8
• Molecular Formula: C12H10N4OS
• Molecular Weight: 258.29900
• DSSTox Substance ID: DTXSID50487180
• Wikidata: Q82329107
• Mol file: 61934-43-8.mol

Synonyms:61934-43-8;6-Amino-5-(1H-indol-3-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one;CTK2D0082;DTXSID50487180;2-thio-5-(3-indolyl)-4-amino-6-hydroxypyrimidine

Chemical Property of 6-Amino-5-(1H-indol-3-yl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one

Chemical Property:

• PSA: 126.62000
• LogP: 2.78260
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 258.05753213
• Heavy Atom Count: 18
• Complexity: 434

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=CN2)C3=C(NC(=S)NC3=O)N