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

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

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

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

structure
  • CAS No:

    729582-64-3

  • Formula:

    C20H19N3OS2

  • Chemical Name:

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

  • Synonyms:

    ZINC3290487;AKOS000877110;MCULE-9139239621;Z19570410;3-{[4-(4-methylphenyl)-3-oxo-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-5-yl]sulfanyl}propanenitrile;729582-64-3

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

381.5 g/mol

381.09695459 g/mol

Characteristics

110 Ų

Computed Properties

Molecular Weight:381.5
XLogP3:4.7
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:381.09695459
Monoisotopic Mass:381.09695459
Topological Polar Surface Area:110
Heavy Atom Count:26
Complexity:620
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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

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