 Home > Encyclopedia > 7-benzylsulfanyl-5-propylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene

7-benzylsulfanyl-5-propylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene

7-benzylsulfanyl-5-propylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene structure

CAS No:
586984-92-1
Formula:
C21H22N4S3
Chemical Name:
7-benzylsulfanyl-5-propylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene
Synonyms:
ZINC2393957;STK558264;AKOS005484145;MCULE-3773143277;5-(benzylsulfanyl)-3-(propylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine;586984-92-1

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7-benzylsulfanyl-5-propylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene Basic Attributes

Molecular Weight：

426.6 g/mol

Exact Mass：

426.10066024 g/mol

Characteristics

PSA：

122 Å²

Computed Properties

Molecular Weight:426.6
XLogP3:7.2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:426.10066024
Monoisotopic Mass:426.10066024
Topological Polar Surface Area:122
Heavy Atom Count:28
Complexity:518
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 7-benzylsulfanyl-5-propylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene

Basic Attributes
Characteristics
Computed Properties

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