7-butyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-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-[2-(3,4-dimethoxyphenyl)ethyl]-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 structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/ed2557d7d3894acbafeba10ecb4e5ffc.png "7-butyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-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")
7-butyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-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:
846600-42-8
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Formula:
C27H32N4O2S2
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Chemical Name:
7-butyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-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:
ZINC2329198;STL304167;AKOS022120926;MCULE-5638225453;4-butyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-9-(methylsulfanyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine;846600-42-8
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CAS No:
7-butyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-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
508.7 g/mol
508.19666862 g/mol
Computed Properties
Molecular Weight:508.7
XLogP3:7.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:10
Exact Mass:508.19666862
Monoisotopic Mass:508.19666862
Topological Polar Surface Area:123
Heavy Atom Count:35
Complexity:675
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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