NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2-bromo-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]butanamide
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IUPAC Traditional name
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2-bromo-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]butanamide
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Synonyms
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2-Bromo-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]butanamide
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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10.257713
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H Acceptors
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3
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H Donor
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1
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LogD (pH = 5.5)
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3.0498679
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LogD (pH = 7.4)
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3.0493028
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Log P
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3.049875
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Molar Refractivity
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69.5101 cm3
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Polarizability
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25.521494 Å3
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Polar Surface Area
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54.88 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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PROPERTIES
PROPERTIES
Safety Information
Bioassay(PubChem)
Storage Warning
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IRRITANT
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Show
data source
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MSDS Link
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PATENTS
PATENTS
PubChem Patent
Google Patent