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Home > Encyclopedia > 3-allyl-2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one

3-allyl-2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one

3-allyl-2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one structure

3-allyl-2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one 

structure
  • CAS No:

    379245-70-2

  • Formula:

    C24H20N2O3S2

  • Chemical Name:

    3-allyl-2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one

  • Synonyms:

    ZINC1801660;AKOS001057254;MCULE-5599596672;UPCMLD0ENAT0513-4994:001;AF-399/15335056;Z13741903;2-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfanyl}-5-(4-methylphenyl)-3-(prop-2-en-1-yl)-3H,4H-thieno[2,3-d]pyrimidin-4-one;3-allyl-2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one

3-allyl-2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one Basic Attributes

448.5572

448.092

Characteristics

105

5.8

Computed Properties

Molecular Weight:448.6
XLogP3:5.8
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:448.09153485
Monoisotopic Mass:448.09153485
Topological Polar Surface Area:105
Heavy Atom Count:31
Complexity:709
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 3-allyl-2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one

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