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

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

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

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

structure
  • CAS No:

    678561-50-7

  • Formula:

    C25H21N3OS2

  • Chemical Name:

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

  • Synonyms:

    4-({[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}methyl)benzonitrile;ZINC2258471;STK844790;AKOS001045995;MCULE-5239520340;678561-50-7

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

443.6 g/mol

443.11260465 g/mol

Characteristics

110 Ų

Computed Properties

Molecular Weight:443.6
XLogP3:6.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:443.11260465
Monoisotopic Mass:443.11260465
Topological Polar Surface Area:110
Heavy Atom Count:31
Complexity:745
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

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