NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-[(1-ethyl-1H-pyrazol-4-yl)methyl]-3-(3-fluoro-4-methoxybenzoyl)piperidine
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IUPAC Traditional name
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1-[(1-ethylpyrazol-4-yl)methyl]-3-(3-fluoro-4-methoxybenzoyl)piperidine
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Synonyms
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{1-[(1-ethyl-1H-pyrazol-4-yl)methyl]-3-piperidinyl}(3-fluoro-4-methoxyphenyl)methanone
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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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16.45451
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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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0.76764697
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LogD (pH = 7.4)
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2.3639755
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Log P
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2.6675985
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Molar Refractivity
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106.9773 cm3
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Polarizability
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36.256565 Å3
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Polar Surface Area
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47.36 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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5
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H Donor
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0
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Log P
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2.98
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LOG S
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-2.85
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Polar Surface Area
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47.36 Å2
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Rotatable Bonds
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4
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent