 Home > Encyclopedia > 2-[(9-methyl-19-thia-2,4,5,7,8,10-hexazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),3,5,8,10,13(18)-hexaen-3-yl)sulfanyl]-1-phenylethanone

2-[(9-methyl-19-thia-2,4,5,7,8,10-hexazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),3,5,8,10,13(18)-hexaen-3-yl)sulfanyl]-1-phenylethanone

2-[(9-methyl-19-thia-2,4,5,7,8,10-hexazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),3,5,8,10,13(18)-hexaen-3-yl)sulfanyl]-1-phenylethanone structure

CAS No:
850187-89-2
Formula:
C21H18N6OS2
Chemical Name:
2-[(9-methyl-19-thia-2,4,5,7,8,10-hexazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),3,5,8,10,13(18)-hexaen-3-yl)sulfanyl]-1-phenylethanone
Synonyms:
STK574947;AKOS005499375;MCULE-2072638481;2-[(2-methyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:1',5'-c]pyrimidin-7-yl)sulfanyl]-1-phenylethanone;850187-89-2

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2-[(9-methyl-19-thia-2,4,5,7,8,10-hexazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),3,5,8,10,13(18)-hexaen-3-yl)sulfanyl]-1-phenylethanone Basic Attributes

Molecular Weight：

434.5 g/mol

Exact Mass：

434.09835157 g/mol

Characteristics

PSA：

132 Å²

Computed Properties

Molecular Weight:434.5
XLogP3:4.8
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:434.09835157
Monoisotopic Mass:434.09835157
Topological Polar Surface Area:132
Heavy Atom Count:30
Complexity:663
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(9-methyl-19-thia-2,4,5,7,8,10-hexazapentacyclo[10.7.0.02,6.07,11.013,18]nonadeca-1(12),3,5,8,10,13(18)-hexaen-3-yl)sulfanyl]-1-phenylethanone

Basic Attributes
Characteristics
Computed Properties

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