2-[benzyl-[7-(2-methylpropyl)-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]ethanol
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![2-[benzyl-[7-(2-methylpropyl)-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]ethanol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/91c22a013e004731a29d4fa376257adc.png "2-[benzyl-[7-(2-methylpropyl)-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]ethanol")
2-[benzyl-[7-(2-methylpropyl)-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]ethanol
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CAS No:
844823-94-5
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Formula:
C26H30N4OS2
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Chemical Name:
2-[benzyl-[7-(2-methylpropyl)-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]ethanol
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Synonyms:
ZINC2405853;STL304200;AKOS022120845;MCULE-2998762606;2-{benzyl[4-(2-methylpropyl)-9-(methylsulfanyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]amino}ethanol;844823-94-5
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CAS No:
2-[benzyl-[7-(2-methylpropyl)-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]ethanol Basic Attributes
478.7 g/mol
478.18610394 g/mol
Computed Properties
Molecular Weight:478.7
XLogP3:6.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:478.18610394
Monoisotopic Mass:478.18610394
Topological Polar Surface Area:116
Heavy Atom Count:33
Complexity:633
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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