Benzonitrile, 2-[(tetrahydro-3-Methyl-2,4,6-trioxo-1(2H)-pyriMidinyl)Methyl]-
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Benzonitrile, 2-[(tetrahydro-3-Methyl-2,4,6-trioxo-1(2H)-pyriMidinyl)Methyl]-
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CAS No:
1246610-72-9
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Formula:
C13H11N3O3
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Chemical Name:
Benzonitrile, 2-[(tetrahydro-3-Methyl-2,4,6-trioxo-1(2H)-pyriMidinyl)Methyl]-
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Synonyms:
Alogliptin Related Compound 25;SCHEMBL10065447;2-[(3-methyl-2,4,6-trioxo-1,3-diazinan-1-yl)methyl]benzonitrile
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CAS No:
Benzonitrile, 2-[(tetrahydro-3-Methyl-2,4,6-trioxo-1(2H)-pyriMidinyl)Methyl]- Basic Attributes
257.24474
257.08
Computed Properties
Molecular Weight:257.24
XLogP3:0.4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:257.08004122
Monoisotopic Mass:257.08004122
Topological Polar Surface Area:81.5
Heavy Atom Count:19
Complexity:465
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Benzonitrile, 2-[(tetrahydro-3-Methyl-2,4,6-trioxo-1(2H)-pyriMidinyl)Methyl]-
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