 Home > Encyclopedia > 5-(2-methylprop-2-enylsulfanyl)-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-(2-methylprop-2-enylsulfanyl)-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-(2-methylprop-2-enylsulfanyl)-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:
488121-70-6
Formula:
C21H20N4S2
Chemical Name:
5-(2-methylprop-2-enylsulfanyl)-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:
ZINC2330439;STK545450;AKOS005474151;MCULE-1271135214;3-[(2-methylprop-2-en-1-yl)sulfanyl]-5-phenyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine;488121-70-6

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5-(2-methylprop-2-enylsulfanyl)-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：

392.5 g/mol

Exact Mass：

392.11293900 g/mol

Characteristics

PSA：

96.6 Å²

Computed Properties

Molecular Weight:392.5
XLogP3:6.9
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:392.11293900
Monoisotopic Mass:392.11293900
Topological Polar Surface Area:96.6
Heavy Atom Count:27
Complexity:552
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(2-methylprop-2-enylsulfanyl)-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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