 Home > Encyclopedia > 7-butyl-14-methylsulfanyl-12-piperazin-1-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene

7-butyl-14-methylsulfanyl-12-piperazin-1-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene

7-butyl-14-methylsulfanyl-12-piperazin-1-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene structure

CAS No:
844825-62-3
Formula:
C21H27N5S2
Chemical Name:
7-butyl-14-methylsulfanyl-12-piperazin-1-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene
Synonyms:
ZINC2405990;STL304158;AKOS022120938;MCULE-9602703872;4-butyl-9-(methylsulfanyl)-7-(piperazin-1-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine;844825-62-3

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7-butyl-14-methylsulfanyl-12-piperazin-1-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene Basic Attributes

Molecular Weight：

413.6 g/mol

Exact Mass：

413.17078823 g/mol

Characteristics

PSA：

108 Å²

Computed Properties

Molecular Weight:413.6
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:413.17078823
Monoisotopic Mass:413.17078823
Topological Polar Surface Area:108
Heavy Atom Count:28
Complexity:531
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 7-butyl-14-methylsulfanyl-12-piperazin-1-yl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene

Basic Attributes
Characteristics
Computed Properties

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