NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
|
2-[4-(4-fluorophenyl)-2-({methyl[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]amino}methyl)phenoxy]-N-[4-(methylsulfanyl)phenyl]acetamide
|
|
|
IUPAC Traditional name
|
2-[4-(4-fluorophenyl)-2-({methyl[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]amino}methyl)phenoxy]-N-[4-(methylsulfanyl)phenyl]acetamide
|
|
|
Synonyms
|
2-{[4'-fluoro-3-({methyl[(4-methyl-1,2,5-oxadiazol-3-yl)methyl]amino}methyl)-4-biphenylyl]oxy}-N-[4-(methylthio)phenyl]acetamide
|
|
|
DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
供应商提供(Chembridge)
Acid pKa
|
12.586903
|
H Acceptors
|
5
|
H Donor
|
1
|
LogD (pH = 5.5)
|
3.932806
|
LogD (pH = 7.4)
|
4.5932684
|
Log P
|
4.6135616
|
Molar Refractivity
|
142.5898 cm3
|
Polarizability
|
54.46431 Å3
|
Polar Surface Area
|
80.49 Å2
|
Rotatable Bonds
|
10
|
Lipinski's Rule of Five
|
false
|
H Acceptors
|
6
|
H Donor
|
1
|
Log P
|
4.74
|
LOG S
|
-5.99
|
Polar Surface Area
|
80.49 Å2
|
Rotatable Bonds
|
9
|
PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent