NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2,3-dihydro-1H-isoindole; 4-methylbenzene-1-sulfonamide
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IUPAC Traditional name
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isoindoline; p-toluenesulfonamide
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Synonyms
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Isoindoline 4-(aminosulphonyl)toluene
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Isoindoline paratoluenesulphonamide
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Isoindoline.PTSA
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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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10.456078
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H Acceptors
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2
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H Donor
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1
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LogD (pH = 5.5)
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1.0926937
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LogD (pH = 7.4)
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1.09236
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Log P
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1.092698
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Molar Refractivity
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43.2571 cm3
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Polarizability
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17.380774 Å3
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Polar Surface Area
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60.16 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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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent