Formula |
C24H26N6O3 |
IUPAC Name |
1-[(1r)-3-[6-(benzylcarbamoylamino)indol-1-yl]-1-(hydroxymethyl)propyl]imidazole-4-carboxamide |
Molecular Mass |
446.502 g·mol−1 |
Heat of Formation |
-160.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.79 ± 1.08 D |
Volume |
528.29 Å 3 |
Surface Area |
461.48 Å 2 |
HOMO Energy |
-8.28 ± 0.55 eV |
LUMO Energy |
-0.21 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 1-[(1r)-1-(hydroxymethyl)-3-[6-(phenylmethylcarbamoylamino)indol-1-yl]propyl]imidazole-4-carboxamide
- 1-[(1r)-1-(hydroxymethyl)-3-[6-[[oxo-(phenylmethylamino)methyl]amino]-1-indolyl]propyl]-4-imidazolecarboxamide
- 1-[(1r)-3-[6-(benzylcarbamoylamino)indol-1-yl]-1-methylol-propyl]imidazole-4-carboxamide
- 1-[(2r)-1-hydroxy-4-[6-(phenylmethylcarbamoylamino)indol-1-yl]butan-2-yl]imidazole-4-carboxamide
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InChIKey |
KCCUBLLGAMGDJL-HXUWFJFHSA-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
O
N
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