NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
|
4-[(3-chlorophenyl)methyl]-1-(quinolin-8-ylmethyl)-1,4-diazepan-5-one
|
|
|
IUPAC Traditional name
|
4-[(3-chlorophenyl)methyl]-1-(quinolin-8-ylmethyl)-1,4-diazepan-5-one
|
|
|
Synonyms
|
4-(3-chlorobenzyl)-1-(8-quinolinylmethyl)-1,4-diazepan-5-one
|
|
|
DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
供应商提供(Chembridge)
H Acceptors
|
3
|
H Donor
|
0
|
LogD (pH = 5.5)
|
1.2186912
|
LogD (pH = 7.4)
|
2.9681633
|
Log P
|
3.5846956
|
Molar Refractivity
|
108.37 cm3
|
Polarizability
|
43.30929 Å3
|
Polar Surface Area
|
36.44 Å2
|
Rotatable Bonds
|
4
|
Lipinski's Rule of Five
|
true
|
H Acceptors
|
3
|
H Donor
|
0
|
Log P
|
4.06
|
LOG S
|
-2.8
|
Polar Surface Area
|
36.44 Å2
|
Rotatable Bonds
|
4
|
PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent