3-[[4-[5-bromo-3-(2H-tetrazol-5-yl)-2-furyl]phenyl]methyl]-2-propyl-1, 5,7,9-tetrazabicyclo[4.3.0]nona-2,5,7-trien-4-one
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![3-[[4-[5-bromo-3-(2H-tetrazol-5-yl)-2-furyl]phenyl]methyl]-2-propyl-1, 5,7,9-tetrazabicyclo[4.3.0]nona-2,5,7-trien-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/dac83b93455e45678d767eacd6ffc403.png "3-[[4-[5-bromo-3-(2H-tetrazol-5-yl)-2-furyl]phenyl]methyl]-2-propyl-1, 5,7,9-tetrazabicyclo[4.3.0]nona-2,5,7-trien-4-one")
3-[[4-[5-bromo-3-(2H-tetrazol-5-yl)-2-furyl]phenyl]methyl]-2-propyl-1, 5,7,9-tetrazabicyclo[4.3.0]nona-2,5,7-trien-4-one
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CAS No:
168153-01-3
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Formula:
C20H17BrN8O2
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Chemical Name:
3-[[4-[5-bromo-3-(2H-tetrazol-5-yl)-2-furyl]phenyl]methyl]-2-propyl-1, 5,7,9-tetrazabicyclo[4.3.0]nona-2,5,7-trien-4-one
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Synonyms:
(1,2,4)Triazolo(1,5-a)pyrimidin-5(1H)-one, 6-((4-(5-bromo-3-(1H-tetrazol-5-yl)-2-furanyl)phenyl)methyl)-7-propyl-;SCHEMBL9254960;CTK4D2922;DTXSID00168533;6-[[4-[5-bromo-3-(2H-tetrazol-5-yl)furan-2-yl]phenyl]methyl]-7-propyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-5-one;LS-156827;[1,2,4]Triazolo[1,5-a]pyrimidin-5(1H)-one,6-[[4-[5-bromo-3-(2H-tetrazol-5-yl)-2-furanyl]phenyl]methyl]-7-propyl-
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CAS No:
3-[[4-[5-bromo-3-(2H-tetrazol-5-yl)-2-furyl]phenyl]methyl]-2-propyl-1, 5,7,9-tetrazabicyclo[4.3.0]nona-2,5,7-trien-4-one Basic Attributes
481.314
480.066
DTXSID00168533
Computed Properties
Molecular Weight:481.3
XLogP3:3.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:480.06578
Monoisotopic Mass:480.06578
Topological Polar Surface Area:127
Heavy Atom Count:31
Complexity:701
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
3-[[4-[5-bromo-3-(2H-tetrazol-5-yl)-2-furyl]phenyl]methyl]-2-propyl-1, 5,7,9-tetrazabicyclo[4.3.0]nona-2,5,7-trien-4-one
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