Formula |
C28H31N5O4 |
IUPAC Name |
n-[(3r,4r)-4-[[4-[5-(dimethylamino)-2-hydroxy-benzoyl]benzoyl]amino]azepan-3-yl]pyridine-4-carboxamide |
Molecular Mass |
501.577 g·mol−1 |
Heat of Formation |
-350.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.76 ± 1.08 D |
Volume |
596.25 Å 3 |
Surface Area |
445.36 Å 2 |
HOMO Energy |
-8.22 ± 0.55 eV |
LUMO Energy |
-1.07 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- n-[(3r,4r)-4-[[4-(5-dimethylamino-2-hydroxy-benzoyl)benzoyl]amino]azepan-3-yl]isonicotinamide
- n-[(3r,4r)-4-[[4-(5-dimethylamino-2-hydroxy-benzoyl)benzoyl]amino]azepan-3-yl]pyridine-4-carboxamide
- n-[(3r,4r)-4-[[4-(5-dimethylamino-2-hydroxy-phenyl)carbonylphenyl]carbonylamino]azepan-3-yl]pyridine-4-carboxamide
- n-[(3r,4r)-4-[[4-(5-dimethylamino-2-hydroxybenzoyl)benzoyl]amino]azepan-3-yl]pyridine-4-carboxamide
- n-[(3r,4r)-4-[[[4-[(5-dimethylamino-2-hydroxyphenyl)-oxomethyl]phenyl]-oxomethyl]amino]-3-azepanyl]-4-pyridinecarboxamide
- n-[4-({4-[5-(dimethylamino)-2-hydroxybenzoyl]benzoyl}amino)azepan-3-yl]isonicotinamide
- r69
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InChIKey |
NYQLXXDGJNYPPH-DNQXCXABSA-N |
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Links |
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Elements |
H
C
O
N
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