10-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one
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![10-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/c436aebe462e46228216a40519b71410.png "10-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one")
10-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one
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CAS No:
731800-45-6
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Formula:
C20H21FN4OS
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Chemical Name:
10-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one
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Synonyms:
NSC744270;ZINC89814102;AKOS034352183;MCULE-2076308431;NSC-744270;Z44502017;10-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(8),2(6),9-trien-12-one;731800-45-6
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CAS No:
10-[[4-(2-fluorophenyl)piperazin-1-yl]methyl]-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-12-one Basic Attributes
384.5 g/mol
384.14201064 g/mol
744270
Computed Properties
Molecular Weight:384.5
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:384.14201064
Monoisotopic Mass:384.14201064
Topological Polar Surface Area:76.2
Heavy Atom Count:27
Complexity:609
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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