13-prop-2-enylsulfanylspiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,16-hexaene-9,1'-cyclopentane]-11-one
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![13-prop-2-enylsulfanylspiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,16-hexaene-9,1'-cyclopentane]-11-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/6008a2fd14814238b1997cf0f5953f47.png "13-prop-2-enylsulfanylspiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,16-hexaene-9,1'-cyclopentane]-11-one")
13-prop-2-enylsulfanylspiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,16-hexaene-9,1'-cyclopentane]-11-one
structure -
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CAS No:
848212-26-0
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Formula:
C20H20N4OS
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Chemical Name:
13-prop-2-enylsulfanylspiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,16-hexaene-9,1'-cyclopentane]-11-one
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Synonyms:
MLS000551686;CHEMBL1365184;HMS2190F16;ZINC8656161;STL054736;AKOS005707738;AKOS032389668;ZINC101156792;MCULE-9176779698;SMR000145611;848212-26-0;9-(allylthio)-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclopentan]-7(12H)-one;9-(prop-2-en-1-ylsulfanyl)-5H-spiro[benzo[h][1,2,4]triazolo[3,4-b]quinazoline-6,1'-cyclopentan]-7-ol
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CAS No:
13-prop-2-enylsulfanylspiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,16-hexaene-9,1'-cyclopentane]-11-one Basic Attributes
364.5 g/mol
364.13578245 g/mol
Computed Properties
Molecular Weight:364.5
XLogP3:4.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:364.13578245
Monoisotopic Mass:364.13578245
Topological Polar Surface Area:82.4
Heavy Atom Count:26
Complexity:747
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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