2-[[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]sulfanyl]ethanol
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![2-[[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]sulfanyl]ethanol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/3d655efad30446739a8ef04f1aa7c5bd.png "2-[[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]sulfanyl]ethanol")
2-[[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]sulfanyl]ethanol
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CAS No:
845633-86-5
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Formula:
C19H23N3OS3
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Chemical Name:
2-[[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]sulfanyl]ethanol
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Synonyms:
ZINC2413138;STL304351;AKOS022120972;MCULE-4681023421;2-{[4-(2-methylpropyl)-9-(methylsulfanyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]sulfanyl}ethanol;845633-86-5
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CAS No:
2-[[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]sulfanyl]ethanol Basic Attributes
405.6 g/mol
405.10032589 g/mol
Computed Properties
Molecular Weight:405.6
XLogP3:5.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:405.10032589
Monoisotopic Mass:405.10032589
Topological Polar Surface Area:138
Heavy Atom Count:26
Complexity:483
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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