 Home > Encyclopedia > 2-[4-(5-bromo-3-methylpyridin-2-yl)butylamino]-5-[(6-methyl-1-oxidopyridin-1-ium-3-yl)methyl]-1H-pyrimidin-6-one

2-[4-(5-bromo-3-methylpyridin-2-yl)butylamino]-5-[(6-methyl-1-oxidopyridin-1-ium-3-yl)methyl]-1H-pyrimidin-6-one

2-[4-(5-bromo-3-methylpyridin-2-yl)butylamino]-5-[(6-methyl-1-oxidopyridin-1-ium-3-yl)methyl]-1H-pyrimidin-6-one structure

CAS No:
86181-44-4
Formula:
C21H24BrN5O2
Chemical Name:
2-[4-(5-bromo-3-methylpyridin-2-yl)butylamino]-5-[(6-methyl-1-oxidopyridin-1-ium-3-yl)methyl]-1H-pyrimidin-6-one
Synonyms:
2-[4-(5-bromo-3-methyl-pyridin-2-yl)butylamino]-5-[(2-methyl-1-oxido-pyridin-5-yl)methyl]-3H-pyrimidin-4-one;

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2-[4-(5-bromo-3-methylpyridin-2-yl)butylamino]-5-[(6-methyl-1-oxidopyridin-1-ium-3-yl)methyl]-1H-pyrimidin-6-one Basic Attributes

Molecular Weight：

458.35200

Exact Mass：

457.11134

DSSTox ID：

DTXSID20235438

Characteristics

PSA：

99.62000

XLogP3：

3.83250

Density：

1.43g/cm3

Refractive Index：

1.65

Computed Properties

Molecular Weight:458.4
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:457.11134
Monoisotopic Mass:457.11134
Topological Polar Surface Area:91.8
Heavy Atom Count:29
Complexity:626
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[4-(5-bromo-3-methylpyridin-2-yl)butylamino]-5-[(6-methyl-1-oxidopyridin-1-ium-3-yl)methyl]-1H-pyrimidin-6-one

Basic Attributes
Characteristics
Computed Properties

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