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Home > Encyclopedia > 5-[(4-bromophenyl)methylsulfanyl]-4-(4-ethoxyphenyl)-11-methyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

5-[(4-bromophenyl)methylsulfanyl]-4-(4-ethoxyphenyl)-11-methyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

5-[(4-bromophenyl)methylsulfanyl]-4-(4-ethoxyphenyl)-11-methyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one structure

5-[(4-bromophenyl)methylsulfanyl]-4-(4-ethoxyphenyl)-11-methyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one 

structure
  • CAS No:

    578701-53-8

  • Formula:

    C25H24BrN3O2S2

  • Chemical Name:

    5-[(4-bromophenyl)methylsulfanyl]-4-(4-ethoxyphenyl)-11-methyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

  • Synonyms:

    STK720633;ZINC97953980;AKOS005529674;MCULE-4827700859;2-[(4-bromobenzyl)sulfanyl]-3-(4-ethoxyphenyl)-7-methyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one;578701-53-8

5-[(4-bromophenyl)methylsulfanyl]-4-(4-ethoxyphenyl)-11-methyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one Basic Attributes

542.5 g/mol

541.04933 g/mol

Characteristics

98.7 Ų

Computed Properties

Molecular Weight:542.5
XLogP3:5.8
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:541.04933
Monoisotopic Mass:541.04933
Topological Polar Surface Area:98.7
Heavy Atom Count:33
Complexity:724
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 5-[(4-bromophenyl)methylsulfanyl]-4-(4-ethoxyphenyl)-11-methyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

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