NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
|
1-(4-benzylpiperazine-1-carbonyl)-6-[(2,4,5-trimethoxyphenyl)methyl]-6-azaspiro[2.5]octane
|
|
|
IUPAC Traditional name
|
1-(4-benzylpiperazine-1-carbonyl)-6-[(2,4,5-trimethoxyphenyl)methyl]-6-azaspiro[2.5]octane
|
|
|
Synonyms
|
1-[(4-benzyl-1-piperazinyl)carbonyl]-6-(2,4,5-trimethoxybenzyl)-6-azaspiro[2.5]octane
|
|
|
DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
供应商提供(Chembridge)
H Acceptors
|
6
|
H Donor
|
0
|
LogD (pH = 5.5)
|
-0.8991473
|
LogD (pH = 7.4)
|
2.1916711
|
Log P
|
2.850082
|
Molar Refractivity
|
141.872 cm3
|
Polarizability
|
55.328568 Å3
|
Polar Surface Area
|
54.48 Å2
|
Rotatable Bonds
|
8
|
Lipinski's Rule of Five
|
true
|
H Acceptors
|
6
|
H Donor
|
0
|
Log P
|
3.27
|
LOG S
|
-1.69
|
Polar Surface Area
|
54.48 Å2
|
Rotatable Bonds
|
5
|
PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent