NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
|
1-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]-3-methyl-3-{[5-(propan-2-yl)-1,2,4-oxadiazol-3-yl]methyl}urea
|
|
|
IUPAC Traditional name
|
1-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-3-[(5-isopropyl-1,2,4-oxadiazol-3-yl)methyl]-3-methylurea
|
|
|
Synonyms
|
N'-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]-N-[(5-isopropyl-1,2,4-oxadiazol-3-yl)methyl]-N-methylurea
|
|
|
DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
供应商提供(Chembridge)
Acid pKa
|
14.592038
|
H Acceptors
|
4
|
H Donor
|
1
|
LogD (pH = 5.5)
|
3.2645307
|
LogD (pH = 7.4)
|
3.2658281
|
Log P
|
3.2658446
|
Molar Refractivity
|
105.8755 cm3
|
Polarizability
|
38.9437 Å3
|
Polar Surface Area
|
89.08 Å2
|
Rotatable Bonds
|
5
|
Lipinski's Rule of Five
|
true
|
H Acceptors
|
5
|
H Donor
|
1
|
Log P
|
2.37
|
LOG S
|
-3.91
|
Polar Surface Area
|
89.08 Å2
|
Rotatable Bonds
|
5
|
PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent