NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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4-[(3-cyclopropyl-1H-1,2,4-triazol-5-yl)methyl]-1-propylpiperidine
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IUPAC Traditional name
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4-[(5-cyclopropyl-2H-1,2,4-triazol-3-yl)methyl]-1-propylpiperidine
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Synonyms
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4-[(3-cyclopropyl-1H-1,2,4-triazol-5-yl)methyl]-1-propylpiperidine
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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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10.43459
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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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-0.9827544
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LogD (pH = 7.4)
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0.33628386
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Log P
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2.2334406
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Molar Refractivity
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74.9578 cm3
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Polarizability
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28.260721 Å3
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Polar Surface Area
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44.81 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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3
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H Donor
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1
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Log P
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1.43
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LOG S
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-1.23
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Polar Surface Area
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44.81 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