NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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4-tert-butyl-2-{N-[(1S,2S)-2-({[5-tert-butyl-2-hydroxy-3-(morpholin-4-ylmethyl)phenyl]methylidene}amino)cyclohexyl]carboximidoyl}-6-(morpholin-4-ylmethyl)phenol
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IUPAC Traditional name
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4-tert-butyl-2-{N-[(1S,2S)-2-({[5-tert-butyl-2-hydroxy-3-(morpholin-4-ylmethyl)phenyl]methylidene}amino)cyclohexyl]carboximidoyl}-6-(morpholin-4-ylmethyl)phenol
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Synonyms
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N,N′-Bis[(E)-5-(tert-butyl)-2-hydroxy-3-(4-morpholinylmethyl)benzylidene]-[(1S,2S)-1,2-cyclohexanediamine]
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2,2′-[(1S,2S)-(+)-1,2-Cyclohexanediylbis[(E)-(nitrilomethylidyne)]]bis[4-(tert-butyl)-6-(4-morpholinylmethyl)phenol]
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N,N′-双[(E)-5-(叔丁基)-2-羟基-3,4-吗啉基甲基)亚苄基]-[(1S,2S)-1,2-环己二胺]
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2,2′-[(1S,2S)-(+)-1,2-环己二基双[(E)-(次氮基次甲基)]]双[4-(叔丁基)-6-(4-吗啉基甲基)苯酚]
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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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8.117441
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H Acceptors
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8
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H Donor
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2
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LogD (pH = 5.5)
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3.4643369
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LogD (pH = 7.4)
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6.550975
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Log P
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6.5541663
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Molar Refractivity
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189.834 cm3
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Polarizability
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72.540535 Å3
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Polar Surface Area
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90.12 Å2
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Rotatable Bonds
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10
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Lipinski's Rule of Five
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false
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DETAILS
DETAILS
Sigma Aldrich
PATENTS
PATENTS
PubChem Patent
Google Patent