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

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

CAS No:
369604-72-8
Formula:
C23H21N3OS2
Chemical Name:
5-benzylsulfanyl-11-methyl-4-phenyl-8-thia-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Synonyms:
GNF-Pf-4226;Oprea1_347605;CHEMBL585469;STL297618;ZINC20813562;AKOS002838185;MCULE-4681618736;2-(benzylsulfanyl)-7-methyl-3-phenyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one;369604-72-8

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

Molecular Weight：

419.6 g/mol

Exact Mass：

419.11260465 g/mol

Characteristics

PSA：

89.4 Å²

Computed Properties

Molecular Weight:419.6
XLogP3:4.8
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:419.11260465
Monoisotopic Mass:419.11260465
Topological Polar Surface Area:89.4
Heavy Atom Count:29
Complexity:630
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-benzylsulfanyl-11-methyl-4-phenyl-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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