NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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1-{2-[1-(3-chloro-2-methylphenyl)-3-(cyclopropylmethyl)-1H-1,2,4-triazol-5-yl]ethyl}-4-methylpiperazine
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IUPAC Traditional name
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1-{2-[2-(3-chloro-2-methylphenyl)-5-(cyclopropylmethyl)-1,2,4-triazol-3-yl]ethyl}-4-methylpiperazine
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Synonyms
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1-{2-[1-(3-chloro-2-methylphenyl)-3-(cyclopropylmethyl)-1H-1,2,4-triazol-5-yl]ethyl}-4-methylpiperazine
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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)
H Acceptors
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4
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H Donor
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0
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LogD (pH = 5.5)
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1.202664
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LogD (pH = 7.4)
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2.994844
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Log P
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3.9239216
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Molar Refractivity
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108.6577 cm3
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Polarizability
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41.843628 Å3
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Polar Surface Area
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37.19 Å2
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Rotatable Bonds
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6
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Lipinski's Rule of Five
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true
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H Acceptors
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4
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H Donor
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0
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Log P
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3.27
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LOG S
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-3.71
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Polar Surface Area
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37.19 Å2
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Rotatable Bonds
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6
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent