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

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

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

CAS No:
371930-49-3
Formula:
C27H27N3OS2
Chemical Name:
11-benzyl-4-(4-methylphenyl)-5-(2-methylprop-2-enylsulfanyl)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Synonyms:
7-benzyl-3-(4-methylphenyl)-2-[(2-methylprop-2-en-1-yl)sulfanyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one;Oprea1_670181;STK081620;ZINC20827115;AKOS005392703;MCULE-6323037779;371930-49-3

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

Molecular Weight：

473.7 g/mol

Exact Mass：

473.15955484 g/mol

Characteristics

PSA：

89.4 Å²

Computed Properties

Molecular Weight:473.7
XLogP3:6.4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:473.15955484
Monoisotopic Mass:473.15955484
Topological Polar Surface Area:89.4
Heavy Atom Count:33
Complexity:757
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 11-benzyl-4-(4-methylphenyl)-5-(2-methylprop-2-enylsulfanyl)-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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