NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-{1-[(7-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)methyl]piperidin-4-yl}-3-methylbutan-1-ol
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IUPAC Traditional name
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1-{1-[(7-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)methyl]piperidin-4-yl}-3-methylbutan-1-ol
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Synonyms
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1-{1-[(7-methoxy-2,3-dihydro-1,4-benzodioxin-6-yl)methyl]-4-piperidinyl}-3-methyl-1-butanol
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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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14.938682
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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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LogD (pH = 5.5)
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0.541792
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LogD (pH = 7.4)
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2.2460275
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Log P
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2.7194493
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Molar Refractivity
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98.656 cm3
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Polarizability
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38.823284 Å3
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Polar Surface Area
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51.16 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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1
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Log P
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2.85
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LOG S
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-3.17
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Polar Surface Area
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51.16 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