N',N'-diethyl-N-(14-methylsulfanyl-7-propan-2-yl-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)ethane-1,2-diamine
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![N',N'-diethyl-N-(14-methylsulfanyl-7-propan-2-yl-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)ethane-1,2-diamine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/0ee268cd6ddb44a3b5601280c9b91f0d.png "N',N'-diethyl-N-(14-methylsulfanyl-7-propan-2-yl-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)ethane-1,2-diamine")
N',N'-diethyl-N-(14-methylsulfanyl-7-propan-2-yl-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)ethane-1,2-diamine
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CAS No:
847174-98-5
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Formula:
C22H31N5S2
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Chemical Name:
N',N'-diethyl-N-(14-methylsulfanyl-7-propan-2-yl-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)ethane-1,2-diamine
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Synonyms:
CHEMBL232624;ZINC5695201;STL304149;AKOS022121162;MCULE-4163225191;847174-98-5;N,N-diethyl-N'-[9-(methylsulfanyl)-4-(propan-2-yl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]ethane-1,2-diamine
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CAS No:
N',N'-diethyl-N-(14-methylsulfanyl-7-propan-2-yl-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)ethane-1,2-diamine Basic Attributes
429.6 g/mol
429.20208836 g/mol
Computed Properties
Molecular Weight:429.6
XLogP3:5.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:429.20208836
Monoisotopic Mass:429.20208836
Topological Polar Surface Area:108
Heavy Atom Count:29
Complexity:531
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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