Formula |
C23H34N6O5S |
IUPAC Name |
2-[(3s)-3-(benzylsulfonylamino)-2-oxo-1-piperidyl]-n-[(1s)-1-[[(3s)-1-carbamimidoyl-3-piperidyl]methyl]-2-oxo-ethyl]acetamide |
Molecular Mass |
506.618 g·mol−1 |
Heat of Formation |
-731.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.90 ± 1.08 D |
Volume |
602.72 Å 3 |
Surface Area |
492.86 Å 2 |
HOMO Energy |
-9.22 ± 0.55 eV |
LUMO Energy |
0.23 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- n-[(1s)-1-[[(3s)-1-amidino-3-piperidyl]methyl]-2-keto-ethyl]-2-[(3s)-3-(benzylsulfonylamino)-2-keto-1-piperidyl]acetamide
- n-[(1s)-1-[[(3s)-1-carbamimidoyl-3-piperidinyl]methyl]-2-oxoethyl]-2-[(3s)-2-oxo-3-(phenylmethylsulfonylamino)-1-piperidinyl]acetamide
- n-[(1s)-1-[[(3s)-1-carbamimidoyl-3-piperidyl]methyl]-2-oxo-ethyl]-2-[(3s)-2-oxo-3-(phenylmethylsulfonylamino)-1-piperidyl]acetamide
- n-[(2s)-1-[(3s)-1-carbamimidoylpiperidin-3-yl]-3-oxo-propan-2-yl]-2-[(3s)-2-oxo-3-(phenylmethylsulfonylamino)piperidin-1-yl]ethanamide
- n-[(2s)-1-[(3s)-1-carbamimidoylpiperidin-3-yl]-3-oxopropan-2-yl]-2-[(3s)-2-oxo-3-(phenylmethylsulfonylamino)piperidin-1-yl]acetamide
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InChIKey |
DATYERRDSFNBDN-UFYCRDLUSA-N |
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Elements |
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