NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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4-cyano-5-{[4-(propan-2-yl)phenyl]amino}-1,2-thiazol-3-yl ethyl ethoxy(sulfanylidene)phosphonite
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IUPAC Traditional name
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4-cyano-5-[(4-isopropylphenyl)amino]-1,2-thiazol-3-yl ethyl ethoxy(sulfanylidene)phosphonite
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Synonyms
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3-[(diethoxyphosphorothioyl)oxy]-5-(4-isopropylanilino)isothiazole-4-carbonitrile
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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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12.802359
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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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5.64632
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LogD (pH = 7.4)
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5.646319
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Log P
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5.6463203
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Molar Refractivity
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109.1775 cm3
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Polarizability
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42.268074 Å3
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Polar Surface Area
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76.4 Å2
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Rotatable Bonds
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9
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Lipinski's Rule of Five
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false
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent