 Home > Encyclopedia > 11-benzyl-5-hexylsulfanyl-4-(4-methylphenyl)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

11-benzyl-5-hexylsulfanyl-4-(4-methylphenyl)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

11-benzyl-5-hexylsulfanyl-4-(4-methylphenyl)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one structure

CAS No:
672893-14-0
Formula:
C29H33N3OS2
Chemical Name:
11-benzyl-5-hexylsulfanyl-4-(4-methylphenyl)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Synonyms:
STK926006;ZINC20567659;AKOS002844643;MCULE-8183402112;672893-14-0;7-benzyl-2-(hexylsulfanyl)-3-(4-methylphenyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one;7-benzyl-2-(hexylthio)-3-(p-tolyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one

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11-benzyl-5-hexylsulfanyl-4-(4-methylphenyl)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one Basic Attributes

Molecular Weight：

503.7 g/mol

Exact Mass：

503.20650503 g/mol

Characteristics

PSA：

89.4 Å²

Computed Properties

Molecular Weight:503.7
XLogP3:7.5
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:503.20650503
Monoisotopic Mass:503.20650503
Topological Polar Surface Area:89.4
Heavy Atom Count:35
Complexity:731
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 11-benzyl-5-hexylsulfanyl-4-(4-methylphenyl)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

Basic Attributes
Characteristics
Computed Properties

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