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Home > Encyclopedia > pentyl 2-[[11-benzyl-4-(4-methylphenyl)-3-oxo-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetate

pentyl 2-[[11-benzyl-4-(4-methylphenyl)-3-oxo-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetate

pentyl 2-[[11-benzyl-4-(4-methylphenyl)-3-oxo-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetate structure

pentyl 2-[[11-benzyl-4-(4-methylphenyl)-3-oxo-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetate 

structure
  • CAS No:

    371206-64-3

  • Formula:

    C30H33N3O3S2

  • Chemical Name:

    pentyl 2-[[11-benzyl-4-(4-methylphenyl)-3-oxo-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetate

  • Synonyms:

    STK538910;ZINC53306831;AKOS005469655;MCULE-3399849798;371206-64-3;pentyl {[7-benzyl-3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate

pentyl 2-[[11-benzyl-4-(4-methylphenyl)-3-oxo-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetate Basic Attributes

547.7 g/mol

547.19633427 g/mol

Characteristics

116 Ų

Computed Properties

Molecular Weight:547.7
XLogP3:6.9
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:11
Exact Mass:547.19633427
Monoisotopic Mass:547.19633427
Topological Polar Surface Area:116
Heavy Atom Count:38
Complexity:841
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of pentyl 2-[[11-benzyl-4-(4-methylphenyl)-3-oxo-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]acetate

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