Umespirone
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Umespirone
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CAS No:
107736-98-1
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Formula:
C28H40N4O5
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Chemical Name:
Umespirone
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Synonyms:
3,7-Diazabicyclo[3.3.1]nonane-2,4,6,8-tetrone,3-butyl-7-[4-[4-(2-methoxyphenyl)-1-piperazinyl]butyl]-9,9-dimethyl-;3-Butyl-7-[4-[4-(2-methoxyphenyl)-1-piperazinyl]butyl]-9,9-dimethyl-3,7-diazabicyclo[3.3.1]nonane-2,4,6,8-tetrone;Umespirone;KC 9172
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CAS No:
Computed Properties
Molecular Weight:512.6
XLogP3:3.4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:512.29987039
Monoisotopic Mass:512.29987039
Topological Polar Surface Area:90.5
Heavy Atom Count:37
Complexity:831
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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