| Formula |
C31H30Cl2N2O4S |
| IUPAC Name |
3-[(1s)-3-[4-chloro-2-(dimethylcarbamoyl)phenyl]-1-[3-[(7-chloro-2-quinolyl)methoxy]phenyl]propyl]sulfanylpropanoic acid |
| Molecular Mass |
597.552 g·mol−1 |
| Heat of Formation |
-519.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.12 ± 1.08 D |
| Volume |
689.64 Å 3 |
| Surface Area |
502.78 Å 2 |
| HOMO Energy |
-8.77 ± 0.55 eV |
| LUMO Energy |
1.81 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 3-[(1s)-3-[4-chloro-2-(dimethylcarbamoyl)phenyl]-1-[3-[(7-chloro-2-quinolyl)methoxy]phenyl]propyl]sulfanylpropanoic acid
- 3-[(1s)-3-[4-chloro-2-(dimethylcarbamoyl)phenyl]-1-[3-[(7-chloroquinolin-2-yl)methoxy]phenyl]propyl]sulfanylpropanoic acid
- 3-[[(1s)-3-[4-chloro-2-(dimethylamino-oxomethyl)phenyl]-1-[3-[(7-chloro-2-quinolyl)methoxy]phenyl]propyl]thio]propanoic acid
- 3-[[(1s)-3-[4-chloro-2-(dimethylcarbamoyl)phenyl]-1-[3-[(7-chloro-2-quinolyl)methoxy]phenyl]propyl]thio]propionic acid
|
| InChIKey |
KOEUMOZAMCRIGA-LJAQVGFWSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
C
Cl
H
O
N
S
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