NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2-{4-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-(thiophen-2-ylmethyl)piperazin-2-yl}ethan-1-ol
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IUPAC Traditional name
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2-{4-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-(thiophen-2-ylmethyl)piperazin-2-yl}ethanol
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Synonyms
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2-[4-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-(2-thienylmethyl)-2-piperazinyl]ethanol
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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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15.921742
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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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-0.50291365
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LogD (pH = 7.4)
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1.2207572
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Log P
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1.7430384
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Molar Refractivity
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92.4144 cm3
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Polarizability
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35.792137 Å3
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Polar Surface Area
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39.6 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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1
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Log P
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2.27
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LOG S
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-1.05
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Polar Surface Area
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39.6 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