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Diss Factsheets

Physical & Chemical properties

Solubility in organic solvents / fat solubility

Administrative data

Endpoint:
solubility in organic solvents / fat solubility
Type of information:
experimental study
Adequacy of study:
supporting study
Study period:
2006
Reliability:
4 (not assignable)
Rationale for reliability incl. deficiencies:
documentation insufficient for assessment

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
2006
Report date:
2006

Materials and methods

Principles of method if other than guideline:
An excess of product is shaken with solvent during 24 hours at 20 deg C. After filtration the concentration in solution is determined with spectrometry.
GLP compliance:
not specified

Test material

Constituent 1
Chemical structure
Reference substance name:
ethyl (1R,4R,6S,7Z,15R,17R)-17-({7-methoxy-8-methyl-2-[4-(propan-2-yl)-1,3-thiazol-2-yl]quinolin-4-yl}oxy)-13-methyl-2,14-dioxo-3,13-diazatricyclo[13.3.0.0^{4,6}]octadec-7-ene-4-carboxylate
EC Number:
618-843-3
Cas Number:
923604-57-3
Molecular formula:
C37H46N4O6S
IUPAC Name:
ethyl (1R,4R,6S,7Z,15R,17R)-17-({7-methoxy-8-methyl-2-[4-(propan-2-yl)-1,3-thiazol-2-yl]quinolin-4-yl}oxy)-13-methyl-2,14-dioxo-3,13-diazatricyclo[13.3.0.0^{4,6}]octadec-7-ene-4-carboxylate
Test material form:
solid
Details on test material:
- Name of test material (as cited in study reports): JNJ-38970191-AAA (T003009)
- Physical state: solid
- Appearance white solid

Results and discussion

Solubility in organic solvents / fat solubilityopen allclose all
Medium:
methanol
Solubility:
2.2 g/L
Temp.:
20 °C
Medium:
ethanol
Solubility:
2 g/L
Temp.:
20 °C
Medium:
other: 2-propanol
Solubility:
1 g/L
Temp.:
20 °C
Medium:
other: dichloromethane
Solubility:
> 200 g/L
Temp.:
20 °C
Medium:
other: 2-propanone
Solubility:
5.8 g/L
Temp.:
20 °C
Medium:
ethyl acetate
Solubility:
5 g/L
Temp.:
20 °C
Medium:
other: methyl benzene
Solubility:
20 g/L
Temp.:
20 °C
Medium:
other: 4-methyl-2-pentanon
Solubility:
8 g/L
Temp.:
20 °C
Medium:
other: 2-butanone
Solubility:
12 g/L
Temp.:
20 °C
Medium:
other: 1-methoxy-2-propanol
Solubility:
13 g/L
Temp.:
20 °C

Any other information on results incl. tables

Results on solubility in organic solvents:

 Solvent  Solubility in g/L solution
N,N-dimethylacetamide   71
 N,N-dimethylformamide 36
 acetonitrile  1.7
 tetrahydrofurane 96
 acetic acid  160
 acetic acid/water (10/90, v/v) (pH = 3.5)  <0.01
 1-butanol 2.8
 2-butanol 2.3 

Applicant's summary and conclusion