N'-(14-methylsulfanyl-7-phenyl-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'-(14-methylsulfanyl-7-phenyl-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/20220812/aacd8cfce8df457e8ae77d976d60126d.png "N'-(14-methylsulfanyl-7-phenyl-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'-(14-methylsulfanyl-7-phenyl-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 -
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CAS No:
847339-54-2
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Formula:
C21H21N5S2
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Chemical Name:
N'-(14-methylsulfanyl-7-phenyl-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:
C21H21N5S2;ZINC2211592;STL303960;AKOS022121164;MCULE-3703334942;847339-54-2;N-[9-(methylsulfanyl)-4-phenyl-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'-(14-methylsulfanyl-7-phenyl-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
407.6 g/mol
407.12383804 g/mol
Computed Properties
Molecular Weight:407.6
XLogP3:4.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:407.12383804
Monoisotopic Mass:407.12383804
Topological Polar Surface Area:130
Heavy Atom Count:28
Complexity:531
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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