| Formula |
C21H21F3IN3O2 |
| IUPAC Name |
[3,4-difluoro-2-(2-fluoro-4-iodo-anilino)phenyl]-[3-hydroxy-3-[(2s)-2-piperidyl]azetidin-1-yl]methanone |
| Molecular Mass |
531.310 g·mol−1 |
| Heat of Formation |
-604.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.19 ± 1.08 D |
| Volume |
503.56 Å 3 |
| Surface Area |
376.83 Å 2 |
| HOMO Energy |
-8.76 ± 0.55 eV |
| LUMO Energy |
-1.15 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- [3,4-difluoro-2-[(2-fluoro-4-iodo-phenyl)amino]phenyl]-[3-hydroxy-3-[(2s)-2-piperidyl]azetidin-1-yl]methanone
- [3,4-difluoro-2-[(2-fluoro-4-iodo-phenyl)amino]phenyl]-[3-hydroxy-3-[(2s)-piperidin-2-yl]azetidin-1-yl]methanone
- [3,4-difluoro-2-[(2-fluoro-4-iodophenyl)amino]phenyl]-[3-hydroxy-3-[(2s)-2-piperidinyl]-1-azetidinyl]methanone
- [3,4-difluoro-2-[(2-fluoro-4-iodophenyl)amino]phenyl]-[3-hydroxy-3-[(2s)-piperidin-2-yl]azetidin-1-yl]methanone
|
| InChIKey |
BSMCAPRUBJMWDF-KRWDZBQOSA-N |
| QR Code |
Generate QR Code |
| Links |
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| DOI |
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| Downloads |
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|
| Elements |
C
F
I
H
O
N
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