N',N'-diethyl-N-(4,4,8-trimethyl-15-methylsulfanyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),13,15-hexaen-13-yl)ethane-1,2-diamine
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![N',N'-diethyl-N-(4,4,8-trimethyl-15-methylsulfanyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),13,15-hexaen-13-yl)ethane-1,2-diamine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/3fd3994c3c564491bf79a687e93033b0.png "N',N'-diethyl-N-(4,4,8-trimethyl-15-methylsulfanyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),13,15-hexaen-13-yl)ethane-1,2-diamine")
N',N'-diethyl-N-(4,4,8-trimethyl-15-methylsulfanyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),13,15-hexaen-13-yl)ethane-1,2-diamine
structure -
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CAS No:
835908-42-4
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Formula:
C22H31N5OS2
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Chemical Name:
N',N'-diethyl-N-(4,4,8-trimethyl-15-methylsulfanyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),13,15-hexaen-13-yl)ethane-1,2-diamine
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Synonyms:
CHEMBL428371;ZINC9461175;STK721618;AKOS005530329;MCULE-2224303300;835908-42-4;N,N-diethyl-N'-[2,2,5-trimethyl-10-(methylsulfanyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]ethane-1,2-diamine
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CAS No:
N',N'-diethyl-N-(4,4,8-trimethyl-15-methylsulfanyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1,7,9,12(17),13,15-hexaen-13-yl)ethane-1,2-diamine Basic Attributes
445.6 g/mol
445.19700298 g/mol
Computed Properties
Molecular Weight:445.6
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:445.19700298
Monoisotopic Mass:445.19700298
Topological Polar Surface Area:117
Heavy Atom Count:30
Complexity:578
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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