Formula |
C21H22ClN3O3 |
IUPAC Name |
n-[(1s,2r)-1-benzyl-3-(dimethylamino)-2-hydroxy-3-oxo-propyl]-5-chloro-1h-indole-2-carboxamide |
Molecular Mass |
399.871 g·mol−1 |
Heat of Formation |
-352.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.12 ± 1.08 D |
Volume |
468.45 Å 3 |
Surface Area |
401.11 Å 2 |
HOMO Energy |
-9.11 ± 0.55 eV |
LUMO Energy |
-0.98 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 5-chloro-n-[(1s,2r)-3-dimethylamino-2-hydroxy-3-oxo-1-(phenylmethyl)propyl]-1h-indole-2-carboxamide
- 5-chloro-n-[(2s,3r)-4-dimethylamino-3-hydroxy-4-oxo-1-phenyl-butan-2-yl]-1h-indole-2-carboxamide
- 5-chloro-n-[(2s,3r)-4-dimethylamino-3-hydroxy-4-oxo-1-phenylbutan-2-yl]-1h-indole-2-carboxamide
- n-[(1s,2r)-1-(benzyl)-3-dimethylamino-2-hydroxy-3-keto-propyl]-5-chloro-1h-indole-2-carboxamide
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InChIKey |
HINJNZFCMLSBCI-PKOBYXMFSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
N
O
Cl
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