Formula |
C20H28N4O6 |
IUPAC Name |
ethyl 2-[[1-[(2s)-2-[[4-[(z)-n'-hydroxycarbamimidoyl]benzoyl]amino]propanoyl]-4-piperidyl]oxy]acetate |
Molecular Mass |
420.460 g·mol−1 |
Heat of Formation |
-872.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.60 ± 1.08 D |
Volume |
502.76 Å 3 |
Surface Area |
446.0 Å 2 |
HOMO Energy |
-9.09 ± 0.55 eV |
LUMO Energy |
-0.67 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-[[1-[(2s)-2-[[4-(aminocarbohydroximoyl)benzoyl]amino]propanoyl]-4-piperidyl]oxy]acetic acid ethyl ester
- 2-[[1-[(2s)-2-[[[4-[(z)-amino-hydroxyiminomethyl]phenyl]-oxomethyl]amino]-1-oxopropyl]-4-piperidinyl]oxy]acetic acid ethyl ester
- d05834
- ethyl 2-[1-[(2s)-2-[[4-(n'-hydroxycarbamimidoyl)benzoyl]amino]propanoyl]piperidin-4-yl]oxyacetate
- ethyl 2-[1-[(2s)-2-[[4-(n'-hydroxycarbamimidoyl)phenyl]carbonylamino]propanoyl]piperidin-4-yl]oxyethanoate
- ethyl 2-[[1-[(2s)-2-[[4-(n'-hydroxycarbamimidoyl)benzoyl]amino]propanoyl]-4-piperidyl]oxy]acetate
- g-7333
- ro-48-3657
- ro-48-3657/000
- sibrafiban (usan)
- xubix
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CAS Number(s) |
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InChIKey |
WBNUCLPUOSXSNJ-ZDUSSCGKSA-N |
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Downloads |
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Elements |
H
C
O
N
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