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Home > Encyclopedia > ethyl 2-[[11-methyl-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

ethyl 2-[[11-methyl-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

ethyl 2-[[11-methyl-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

ethyl 2-[[11-methyl-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:

    372970-94-0

  • Formula:

    C21H23N3O3S2

  • Chemical Name:

    ethyl 2-[[11-methyl-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:

    Oprea1_741895;MLS001173569;CHEMBL1589957;HMS2875A10;STK525273;ZINC19707641;AKOS002838212;MCULE-4766827313;SMR000538738;372970-94-0;ethyl {[7-methyl-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

ethyl 2-[[11-methyl-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

429.6 g/mol

429.11808395 g/mol

Characteristics

116 Ų

Computed Properties

Molecular Weight:429.6
XLogP3:3.9
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:429.11808395
Monoisotopic Mass:429.11808395
Topological Polar Surface Area:116
Heavy Atom Count:29
Complexity:666
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of ethyl 2-[[11-methyl-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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