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Home > Encyclopedia > 4-[[3-(4-bromophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanylmethyl]benzonitrile

4-[[3-(4-bromophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanylmethyl]benzonitrile

4-[[3-(4-bromophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanylmethyl]benzonitrile structure

4-[[3-(4-bromophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanylmethyl]benzonitrile 

structure
  • CAS No:

    677768-43-3

  • Formula:

    C24H18BrN3OS2

  • Chemical Name:

    4-[[3-(4-bromophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanylmethyl]benzonitrile

  • Synonyms:

    4-({[3-(4-bromophenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}methyl)benzonitrile;C24H18BrN3OS2;MLS003128039;ZINC2263087;STK554670;AKOS005481304;MCULE-9098462314;SMR001836099;ST50425214;4-(((3-(4-bromophenyl)-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)methyl)benzonitrile;4-{[3-(4-bromophenyl)-4-oxo-3,5,6,7,8-pentahydrobenzo[b]thiopheno[2,3-d]pyrimi din-2-ylthio]methyl}benzenecarbonitrile;677768-43-3

4-[[3-(4-bromophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanylmethyl]benzonitrile Basic Attributes

508.5 g/mol

507.00747 g/mol

Characteristics

110 Ų

Computed Properties

Molecular Weight:508.5
XLogP3:6.5
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:507.00747
Monoisotopic Mass:507.00747
Topological Polar Surface Area:110
Heavy Atom Count:31
Complexity:751
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 4-[[3-(4-bromophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanylmethyl]benzonitrile

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