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7-butyl-N-(2-methylpropyl)-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
7-butyl-N-(2-methylpropyl)-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-(2-methylpropyl)-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 structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/a63b7fc155904c34bdc292ff4bf0121f.png "7-butyl-N-(2-methylpropyl)-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")
7-butyl-N-(2-methylpropyl)-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
structure -
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CAS No:
799780-78-2
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Formula:
C20H26N4S
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Chemical Name:
7-butyl-N-(2-methylpropyl)-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:
ZINC2211705;AKOS030520024;MCULE-9304475412;799780-78-2
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CAS No:
7-butyl-N-(2-methylpropyl)-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
354.5 g/mol
354.18781802 g/mol
Computed Properties
Molecular Weight:354.5
XLogP3:6.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:354.18781802
Monoisotopic Mass:354.18781802
Topological Polar Surface Area:78.9
Heavy Atom Count:25
Complexity:445
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 7-butyl-N-(2-methylpropyl)-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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