NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1,3-dihydro-2-benzothiophene-5-carbothioamide
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IUPAC Traditional name
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1,3-dihydro-2-benzothiophene-5-carbothioamide
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Synonyms
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1,3-Dihydrobenzo[c]thiophene-5-thiocarboxamide
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2,7-二氢苯并[c]噻吩-4-硫代甲酰胺
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CAS Number
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MDL Number
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PubChem SID
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PubChem CID
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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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12.48935
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H Acceptors
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0
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H Donor
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1
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LogD (pH = 5.5)
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2.232234
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LogD (pH = 7.4)
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2.232237
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Log P
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2.2322338
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Molar Refractivity
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59.2266 cm3
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Polarizability
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22.565369 Å3
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Polar Surface Area
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26.02 Å2
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Rotatable Bonds
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1
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Lipinski's Rule of Five
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true
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PATENTS
PATENTS
PubChem Patent
Google Patent