| Formula |
C30H36N6O6S |
| IUPAC Name |
2-[benzyl-[(2s)-4-[[(3s)-1-carbamimidoyl-3-piperidyl]methylamino]-2-(2-naphthylsulfonylamino)-4-oxo-butanoyl]amino]acetic acid |
| Molecular Mass |
608.708 g·mol−1 |
| Heat of Formation |
-804.2 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.32 ± 1.08 D |
| Volume |
717.61 Å 3 |
| Surface Area |
519.1 Å 2 |
| HOMO Energy |
-9.27 ± 0.55 eV |
| LUMO Energy |
-0.95 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-[[(2s)-4-[[(3s)-1-amidino-3-piperidyl]methylamino]-4-keto-2-(2-naphthylsulfonylamino)butanoyl]-(benzyl)amino]acetic acid
- 2-[[(2s)-4-[[(3s)-1-carbamimidoyl-3-piperidinyl]methylamino]-2-(2-naphthylsulfonylamino)-1,4-dioxobutyl]-(phenylmethyl)amino]acetic acid
- 2-[[(2s)-4-[[(3s)-1-carbamimidoyl-3-piperidyl]methylamino]-2-(2-naphthylsulfonylamino)-4-oxo-butanoyl]-(phenylmethyl)amino]acetic acid
- 2-[[(2s)-4-[[(3s)-1-carbamimidoylpiperidin-3-yl]methylamino]-2-(naphthalen-2-ylsulfonylamino)-4-oxo-butanoyl]-(phenylmethyl)amino]ethanoic acid
- 2-[[(2s)-4-[[(3s)-1-carbamimidoylpiperidin-3-yl]methylamino]-2-(naphthalen-2-ylsulfonylamino)-4-oxobutanoyl]-(phenylmethyl)amino]acetic acid
|
| InChIKey |
ZWJYDBRLGHLMKT-NVQXNPDNSA-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
S
O
N
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