Formula |
C31H37N5O3 |
IUPAC Name |
3-amino-3-methyl-n-[(3r)-1-[[4-[2-[(methylcarbamoylamino)methyl]phenyl]phenyl]methyl]-2-oxo-4,5-dihydro-3h-1-benzazepin-3-yl]butanamide |
Molecular Mass |
527.657 g·mol−1 |
Heat of Formation |
-365.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.75 ± 1.08 D |
Volume |
669.4 Å 3 |
Surface Area |
506.54 Å 2 |
HOMO Energy |
-8.72 ± 0.55 eV |
LUMO Energy |
-0.09 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-amino-3-methyl-n-[(3r)-1-[[4-[2-[(methylcarbamoylamino)methyl]phenyl]phenyl]methyl]-2-oxo-4,5-dihydro-3h-1-benzazepin-3-yl]butanamide
- 3-amino-n-[(3r)-2-keto-1-[4-[2-[(methylcarbamoylamino)methyl]phenyl]benzyl]-4,5-dihydro-3h-1-benzazepin-3-yl]-3-methyl-butyramide
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InChIKey |
DDHRZXVHYVZDBS-AREMUKBSSA-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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