7-butyl-N-(3-methylbutyl)-14-methylsulfanyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-amine
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7-butyl-N-(3-methylbutyl)-14-methylsulfanyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-amine
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CAS No:
844825-30-5
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Formula:
C22H30N4S2
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Chemical Name:
7-butyl-N-(3-methylbutyl)-14-methylsulfanyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-amine
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Synonyms:
ZINC2406355;STL146219;AKOS005716055;MCULE-4110151458;4-butyl-N-(3-methylbutyl)-9-(methylsulfanyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine;844825-30-5
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CAS No:
7-butyl-N-(3-methylbutyl)-14-methylsulfanyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-amine Basic Attributes
414.6 g/mol
414.19118932 g/mol
Computed Properties
Molecular Weight:414.6
XLogP3:7.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:414.19118932
Monoisotopic Mass:414.19118932
Topological Polar Surface Area:104
Heavy Atom Count:28
Complexity:505
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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