NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2-methoxy-1-{3-[4-methyl-5-(morpholin-4-ylmethyl)-4H-1,2,4-triazol-3-yl]piperidin-1-yl}ethan-1-one
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IUPAC Traditional name
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2-methoxy-1-{3-[4-methyl-5-(morpholin-4-ylmethyl)-1,2,4-triazol-3-yl]piperidin-1-yl}ethanone
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Synonyms
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4-({5-[1-(methoxyacetyl)piperidin-3-yl]-4-methyl-4H-1,2,4-triazol-3-yl}methyl)morpholine
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
供应商提供(Chembridge)
Acid pKa
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19.830547
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H Acceptors
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6
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H Donor
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0
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LogD (pH = 5.5)
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-1.3339651
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LogD (pH = 7.4)
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-1.2684685
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Log P
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-1.2675662
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Molar Refractivity
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91.8075 cm3
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Polarizability
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34.68171 Å3
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Polar Surface Area
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72.72 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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H Acceptors
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6
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H Donor
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0
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Log P
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-0.54
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LOG S
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-2.51
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Polar Surface Area
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72.72 Å2
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Rotatable Bonds
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5
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent