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

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

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

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

structure
  • CAS No:

    499102-71-5

  • Formula:

    C24H18ClN3OS2

  • Chemical Name:

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

  • Synonyms:

    4-({[3-(4-chlorophenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}methyl)benzonitrile;ZINC2218834;STK079379;AKOS002173990;MCULE-8455729828;ST50060445;4-{[3-(4-chlorophenyl)-4-oxo-3,5,6,7,8-pentahydrobenzo[b]thiopheno[2,3-d]pyrim idin-2-ylthio]methyl}benzenecarbonitrile;499102-71-5

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

464.0 g/mol

463.0579822 g/mol

Characteristics

110 Ų

Computed Properties

Molecular Weight:464.0
XLogP3:6.5
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:463.0579822
Monoisotopic Mass:463.0579822
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-chlorophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanylmethyl]benzonitrile

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