NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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N-[1-phenyl-2-(1H-pyrazol-1-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
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IUPAC Traditional name
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N-[1-phenyl-2-(pyrazol-1-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
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Synonyms
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N-[1-phenyl-2-(1H-pyrazol-1-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
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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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14.746175
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H Acceptors
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4
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H Donor
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1
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LogD (pH = 5.5)
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2.5743847
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LogD (pH = 7.4)
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2.5745142
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Log P
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2.5745158
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Molar Refractivity
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108.2657 cm3
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Polarizability
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37.147053 Å3
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Polar Surface Area
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65.38 Å2
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Rotatable Bonds
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5
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Lipinski's Rule of Five
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true
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H Acceptors
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5
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H Donor
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1
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Log P
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3.03
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LOG S
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-4.33
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Polar Surface Area
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65.38 Å2
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Rotatable Bonds
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5
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent