NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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[(4-methanesulfonylphenyl)methyl](methyl)[1-(pyridin-3-yl)propyl]amine
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IUPAC Traditional name
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[(4-methanesulfonylphenyl)methyl](methyl)[1-(pyridin-3-yl)propyl]amine
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Synonyms
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N-methyl-N-[4-(methylsulfonyl)benzyl]-1-pyridin-3-ylpropan-1-amine
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
供应商提供(Chembridge)
Acid pKa
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19.698076
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H Acceptors
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4
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H Donor
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0
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LogD (pH = 5.5)
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0.9126379
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LogD (pH = 7.4)
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2.109859
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Log P
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2.2008493
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Molar Refractivity
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90.0028 cm3
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Polarizability
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35.727478 Å3
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Polar Surface Area
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50.27 Å2
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Rotatable Bonds
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6
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Lipinski's Rule of Five
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true
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H Acceptors
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4
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H Donor
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0
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Log P
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1.44
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LOG S
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-0.45
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Polar Surface Area
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50.27 Å2
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Rotatable Bonds
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6
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent