2-[2-[(7-butyl-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-yl)amino]ethoxy]ethanol
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![2-[2-[(7-butyl-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-yl)amino]ethoxy]ethanol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/eb4041531b2a480d827bbf71b0bc5a3b.png "2-[2-[(7-butyl-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-yl)amino]ethoxy]ethanol")
2-[2-[(7-butyl-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-yl)amino]ethoxy]ethanol
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CAS No:
847380-12-5
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Formula:
C21H28N4O2S2
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Chemical Name:
2-[2-[(7-butyl-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-yl)amino]ethoxy]ethanol
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Synonyms:
ZINC2332960;STL227065;AKOS025272372;MCULE-3816518869;2-(2-{[4-butyl-9-(methylsulfanyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]amino}ethoxy)ethanol;847380-12-5
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CAS No:
2-[2-[(7-butyl-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-yl)amino]ethoxy]ethanol Basic Attributes
432.6 g/mol
432.16536850 g/mol
Computed Properties
Molecular Weight:432.6
XLogP3:4.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:10
Exact Mass:432.16536850
Monoisotopic Mass:432.16536850
Topological Polar Surface Area:134
Heavy Atom Count:29
Complexity:517
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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