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

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

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

CAS No:
372088-38-5
Formula:
C29H33N3OS2
Chemical Name:
4,11-dibenzyl-5-hexylsulfanyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Synonyms:
STK698842;ZINC20840471;AKOS005521552;MCULE-6290032035;3,7-dibenzyl-2-(hexylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one;372088-38-5

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4,11-dibenzyl-5-hexylsulfanyl-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
XLogP3:7.1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:10
Exact Mass:503.20650503
Monoisotopic Mass:503.20650503
Topological Polar Surface Area:89.4
Heavy Atom Count:35
Complexity:719
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4,11-dibenzyl-5-hexylsulfanyl-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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