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

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

5-hexylsulfanyl-7-phenyl-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:
488093-73-8
Formula:
C23H26N4S2
Chemical Name:
5-hexylsulfanyl-7-phenyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene
Synonyms:
C23H26N4S2;ZINC2326005;STK545525;AKOS005474287;MCULE-1123362000;3-(hexylsulfanyl)-5-phenyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine;488093-73-8

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5-hexylsulfanyl-7-phenyl-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：

422.6 g/mol

Exact Mass：

422.15988919 g/mol

Characteristics

PSA：

96.6 Å²

Computed Properties

Molecular Weight:422.6
XLogP3:7.9
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:422.15988919
Monoisotopic Mass:422.15988919
Topological Polar Surface Area:96.6
Heavy Atom Count:29
Complexity:529
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-hexylsulfanyl-7-phenyl-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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