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Home > Encyclopedia > 5-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl-4-phenyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one

5-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl-4-phenyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one

5-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl-4-phenyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one structure

5-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl-4-phenyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one 

structure
  • CAS No:

    690642-75-2

  • Formula:

    C26H22N2O4S2

  • Chemical Name:

    5-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl-4-phenyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one

  • Synonyms:

    690642-75-2;2-((2-(benzo[d][1,3]dioxol-5-yl)-2-oxoethyl)thio)-3-phenyl-6,7,8,9-tetrahydro-3H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4(5H)-one;5-{[2-(2H-1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl}-4-phenyl-8-thia-4,6-diazatricyclo[7.5.0.0^{2,7}]tetradeca-1(9),2(7),5-trien-3-one;ZINC2845915;AKOS000813138;MCULE-9363336543;F3394-0685;5-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl-4-phenyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one

5-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl-4-phenyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one Basic Attributes

490.6 g/mol

490.10209953 g/mol

Characteristics

122 Ų

Computed Properties

Molecular Weight:490.6
XLogP3:6.4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:490.10209953
Monoisotopic Mass:490.10209953
Topological Polar Surface Area:122
Heavy Atom Count:34
Complexity:817
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 5-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl-4-phenyl-8-thia-4,6-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),5-trien-3-one

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