NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
|
3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoic acid
|
|
|
IUPAC Traditional name
|
3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoic acid
|
|
|
Synonyms
|
3-(3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl)propanoic acid
|
3-[3-(4-Chlorophenyl)-1,2,4-oxadiazol-5-yl]-propanoic acid
|
3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]propanoic acid
|
|
|
CAS Number
|
|
MDL Number
|
|
PubChem SID
|
|
PubChem CID
|
|
DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
|
4.209762
|
H Acceptors
|
4
|
H Donor
|
1
|
LogD (pH = 5.5)
|
1.4091413
|
LogD (pH = 7.4)
|
-0.32626137
|
Log P
|
2.718921
|
Molar Refractivity
|
72.224 cm3
|
Polarizability
|
23.711233 Å3
|
Polar Surface Area
|
76.22 Å2
|
Rotatable Bonds
|
4
|
Lipinski's Rule of Five
|
true
|
PATENTS
PATENTS
PubChem Patent
Google Patent