NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
|
2-methyl-N-{1-[1-(pyrimidin-2-yl)piperidin-4-yl]-1H-pyrazol-5-yl}benzamide
|
|
|
IUPAC Traditional name
|
2-methyl-N-{2-[1-(pyrimidin-2-yl)piperidin-4-yl]pyrazol-3-yl}benzamide
|
|
|
Synonyms
|
2-methyl-N-[1-(1-pyrimidin-2-ylpiperidin-4-yl)-1H-pyrazol-5-yl]benzamide
|
|
|
DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
供应商提供(Chembridge)
Acid pKa
|
14.271532
|
H Acceptors
|
5
|
H Donor
|
1
|
LogD (pH = 5.5)
|
2.766589
|
LogD (pH = 7.4)
|
2.7688758
|
Log P
|
2.7689052
|
Molar Refractivity
|
117.3493 cm3
|
Polarizability
|
38.858078 Å3
|
Polar Surface Area
|
75.94 Å2
|
Rotatable Bonds
|
4
|
Lipinski's Rule of Five
|
true
|
H Acceptors
|
4
|
H Donor
|
1
|
Log P
|
3.05
|
LOG S
|
-4.45
|
Polar Surface Area
|
75.94 Å2
|
Rotatable Bonds
|
4
|
PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent