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Home > Encyclopedia > 7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]purine-2,6-dione

7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]purine-2,6-dione

7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]purine-2,6-dione structure

7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]purine-2,6-dione 

structure
  • CAS No:

    797775-51-0

  • Formula:

    C17H16ClN7O2S

  • Chemical Name:

    7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]purine-2,6-dione

  • Synonyms:

    797775-51-0;7-(2-chlorobenzyl)-1,3-dimethyl-8-((4-methyl-4H-1,2,4-triazol-3-yl)thio)-1H-purine-2,6(3H,7H)-dione;SMR000014925;BAS 08333525;7-(2-Chloro-benzyl)-1,3-dimethyl-8-(4-methyl-4H-[1,2,4]triazol-3-ylsulfanyl)-3,7-dihydro-purine-2,6-dione;MLS000075083;MLS002538612;CHEMBL1343754;HMS2383M15;ZINC812613;STL002875;AKOS000723218;MCULE-6079559215;ST50285578;AB00405190-05;AB00405190-11;SR-01000363144;SR-01000363144-1;F1614-0314;7-(2-chlorobenzyl)-1,3-dimethyl-8-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione;7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-(4-methyl(1,2,4-triazol-3-ylthio))-1 ,3,7-trihydropurine-2,6-dione

7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]purine-2,6-dione Basic Attributes

417.9 g/mol

417.0774716 g/mol

Characteristics

114 Ų

Computed Properties

Molecular Weight:417.9
XLogP3:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:417.0774716
Monoisotopic Mass:417.0774716
Topological Polar Surface Area:114
Heavy Atom Count:28
Complexity:628
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 7-[(2-chlorophenyl)methyl]-1,3-dimethyl-8-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]purine-2,6-dione

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