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Home > Encyclopedia > 4-(3-chlorophenyl)-11-methyl-5-piperazin-1-yl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

4-(3-chlorophenyl)-11-methyl-5-piperazin-1-yl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

4-(3-chlorophenyl)-11-methyl-5-piperazin-1-yl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one structure

4-(3-chlorophenyl)-11-methyl-5-piperazin-1-yl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one 

structure
  • CAS No:

    848732-49-0

  • Formula:

    C20H22ClN5OS

  • Chemical Name:

    4-(3-chlorophenyl)-11-methyl-5-piperazin-1-yl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

  • Synonyms:

    ZINC2425709;STK579685;AKOS005504081;MCULE-9886753773;3-(3-chlorophenyl)-7-methyl-2-(piperazin-1-yl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one;848732-49-0

4-(3-chlorophenyl)-11-methyl-5-piperazin-1-yl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one Basic Attributes

415.9 g/mol

415.1233592 g/mol

Characteristics

79.4 Ų

Computed Properties

Molecular Weight:415.9
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:415.1233592
Monoisotopic Mass:415.1233592
Topological Polar Surface Area:79.4
Heavy Atom Count:28
Complexity:642
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 4-(3-chlorophenyl)-11-methyl-5-piperazin-1-yl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

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