14-benzylsulfanyl-N-(2-methoxyethyl)-7-phenyl-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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![14-benzylsulfanyl-N-(2-methoxyethyl)-7-phenyl-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/20220811/79f8c6d60bff4caeb017d743f8613497.png "14-benzylsulfanyl-N-(2-methoxyethyl)-7-phenyl-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")
14-benzylsulfanyl-N-(2-methoxyethyl)-7-phenyl-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:
843616-01-3
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Formula:
C28H26N4OS2
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Chemical Name:
14-benzylsulfanyl-N-(2-methoxyethyl)-7-phenyl-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:
ZINC8744323;STK721741;AKOS005530320;MCULE-1966962210;843616-01-3;9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine
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CAS No:
14-benzylsulfanyl-N-(2-methoxyethyl)-7-phenyl-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
498.7 g/mol
498.15480381 g/mol
Computed Properties
Molecular Weight:498.7
XLogP3:6.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:498.15480381
Monoisotopic Mass:498.15480381
Topological Polar Surface Area:114
Heavy Atom Count:35
Complexity:673
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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