| Formula |
C23H23ClFNO5 |
| IUPAC Name |
6-[(3-chloro-2-fluoro-phenyl)methyl]-1-[(1s)-1-(hydroxymethyl)-2-methyl-propyl]-7-methoxy-4-oxo-quinoline-3-carboxylic acid |
| Molecular Mass |
447.884 g·mol−1 |
| Heat of Formation |
-953.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
9.26 ± 1.08 D |
| Volume |
504.76 Å 3 |
| Surface Area |
417.2 Å 2 |
| HOMO Energy |
-8.96 ± 0.55 eV |
| LUMO Energy |
2.15 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 3-quinolinecarboxylic acid, 6-[(3-chloro-2-fluorophenyl)methyl]-1,4-dihydro-1-[(1s)-1-isopropyl-2-hydroxyethyl]-7-methoxy-4-oxo-
- 6-(3-chloro-2-fluoro-benzyl)-4-keto-7-methoxy-1-[(1s)-2-methyl-1-methylol-propyl]quinoline-3-carboxylic acid
- 6-[(3-chloro-2-fluoro-phenyl)methyl]-1-[(1s)-1-(hydroxymethyl)-2-methyl-propyl]-7-methoxy-4-oxo-quinoline-3-carboxylic acid
- 6-[(3-chloro-2-fluoro-phenyl)methyl]-1-[(2s)-1-hydroxy-3-methyl-butan-2-yl]-7-methoxy-4-oxo-quinoline-3-carboxylic acid
- 6-[(3-chloro-2-fluorophenyl)methyl]-1-[(1s)-1-(hydroxymethyl)-2-methylpropyl]-7-methoxy-4-oxo-3-quinolinecarboxylic acid
- 6-[(3-chloro-2-fluorophenyl)methyl]-1-[(2s)-1-hydroxy-3-methylbutan-2-yl]-7-methoxy-4-oxoquinoline-3-carboxylic acid
- gs-9137
- jtk-303
|
| InChIKey |
JUZYLCPPVHEVSV-LJQANCHMSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
Wikipedia
ChemSpider
|
| DOI |
|
| Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
| Elements |
C
F
H
Cl
O
N
|
| |
|
