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

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

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

CAS No:
488131-23-3
Formula:
C25H25N3OS2
Chemical Name:
11-benzyl-5-ethylsulfanyl-4-(3-methylphenyl)-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Synonyms:
STK541625;ZINC20065107;AKOS005471703;MCULE-6191437963;488131-23-3;7-benzyl-2-(ethylsulfanyl)-3-(3-methylphenyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one

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11-benzyl-5-ethylsulfanyl-4-(3-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：

447.6 g/mol

Exact Mass：

447.14390478 g/mol

Characteristics

PSA：

89.4 Å²

Computed Properties

Molecular Weight:447.6
XLogP3:5.5
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:447.14390478
Monoisotopic Mass:447.14390478
Topological Polar Surface Area:89.4
Heavy Atom Count:31
Complexity:680
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 11-benzyl-5-ethylsulfanyl-4-(3-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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