NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
|
2-(6-bromo-2,4-dihydro-1,3-benzodioxin-8-yl)-7-methoxy-4H-chromen-4-one
|
|
|
IUPAC Traditional name
|
2-(6-bromo-2,4-dihydro-1,3-benzodioxin-8-yl)-7-methoxychromen-4-one
|
|
|
DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
|
15.095791
|
H Acceptors
|
5
|
H Donor
|
0
|
LogD (pH = 5.5)
|
3.235148
|
LogD (pH = 7.4)
|
3.235148
|
Log P
|
3.235148
|
Molar Refractivity
|
91.928 cm3
|
Polarizability
|
34.948265 Å3
|
Polar Surface Area
|
53.99 Å2
|
Rotatable Bonds
|
2
|
Lipinski's Rule of Five
|
true
|
PROPERTIES
PROPERTIES
Product Information
Bioassay(PubChem)
Classification
|
Rare Derivatives of Natural Compounds
|
Show
data source
|
|
PATENTS
PATENTS
PubChem Patent
Google Patent