| Formula |
C32H27F3N2O4S |
| IUPAC Name |
2-[7-[[2-(3-morpholinoprop-1-ynyl)-6-[2-[4-(trifluoromethyl)phenyl]ethynyl]-4-pyridyl]sulfanyl]indan-4-yl]oxyacetic acid |
| Molecular Mass |
592.628 g·mol−1 |
| Heat of Formation |
-534.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.37 ± 1.08 D |
| Volume |
671.68 Å 3 |
| Surface Area |
599.11 Å 2 |
| HOMO Energy |
-8.48 ± 0.55 eV |
| LUMO Energy |
1.49 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-[7-[[2-(3-morpholinoprop-1-ynyl)-6-[2-[4-(trifluoromethyl)phenyl]ethynyl]-4-pyridyl]thio]indan-4-yl]oxyacetic acid
- 2-[[7-[2-(3-morpholin-4-ylprop-1-ynyl)-6-[2-[4-(trifluoromethyl)phenyl]ethynyl]pyridin-4-yl]sulfanyl-2,3-dihydro-1h-inden-4-yl]oxy]acetic acid
- 2-[[7-[2-(3-morpholin-4-ylprop-1-ynyl)-6-[2-[4-(trifluoromethyl)phenyl]ethynyl]pyridin-4-yl]sulfanyl-2,3-dihydro-1h-inden-4-yl]oxy]ethanoic acid
- 2-[[7-[[2-(3-morpholinoprop-1-ynyl)-6-[2-[4-(trifluoromethyl)phenyl]ethynyl]-4-pyridyl]thio]-4-indanyl]oxy]acetic acid
|
| InChIKey |
AKQAEZPFLKFQCZ-UHFFFAOYSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
C
F
H
O
N
S
|
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