Formula |
C18H24N4O5 |
IUPAC Name |
2-[[1-[(2s)-2-[(4-carbamimidoylbenzoyl)amino]propanoyl]-4-piperidyl]oxy]acetic acid |
Molecular Mass |
376.407 g·mol−1 |
Heat of Formation |
-784.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.88 ± 1.08 D |
Volume |
446.32 Å 3 |
Surface Area |
395.72 Å 2 |
HOMO Energy |
-9.63 ± 0.55 eV |
LUMO Energy |
-0.62 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-[1-[(2s)-2-[(4-carbamimidoylbenzoyl)amino]propanoyl]piperidin-4-yl]oxyacetic acid
- 2-[1-[(2s)-2-[(4-carbamimidoylphenyl)carbonylamino]propanoyl]piperidin-4-yl]oxyethanoic acid
- 2-[[1-[(2s)-2-[(4-amidinobenzoyl)amino]propanoyl]-4-piperidyl]oxy]acetic acid
- 2-[[1-[(2s)-2-[(4-carbamimidoylbenzoyl)amino]propanoyl]-4-piperidyl]oxy]acetic acid
- 2-[[1-[(2s)-2-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-1-oxopropyl]-4-piperidinyl]oxy]acetic acid
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InChIKey |
BHOGTSLQMNCJHA-NSHDSACASA-N |
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Links |
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Elements |
H
C
O
N
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