NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
|
2-[3-oxo-1-(propan-2-yl)piperazin-2-yl]-N-{2-[4-(propan-2-yloxy)phenyl]ethyl}acetamide
|
|
|
IUPAC Traditional name
|
N-[2-(4-isopropoxyphenyl)ethyl]-2-(1-isopropyl-3-oxopiperazin-2-yl)acetamide
|
|
|
Synonyms
|
N-[2-(4-isopropoxyphenyl)ethyl]-2-(1-isopropyl-3-oxo-2-piperazinyl)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
|
14.218516
|
H Acceptors
|
4
|
H Donor
|
2
|
LogD (pH = 5.5)
|
0.054970626
|
LogD (pH = 7.4)
|
1.4832531
|
Log P
|
1.6592761
|
Molar Refractivity
|
102.2364 cm3
|
Polarizability
|
39.999916 Å3
|
Polar Surface Area
|
70.67 Å2
|
Rotatable Bonds
|
8
|
Lipinski's Rule of Five
|
true
|
H Acceptors
|
4
|
H Donor
|
2
|
Log P
|
2.86
|
LOG S
|
-2.1
|
Polar Surface Area
|
70.67 Å2
|
Rotatable Bonds
|
6
|
PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent