Formula |
C26H28N4O5S |
IUPAC Name |
(2r)-1-[(2s)-3-(3-carbamimidoylphenyl)-2-(2-naphthylsulfonylamino)propanoyl]piperidine-2-carboxylic acid |
Molecular Mass |
508.589 g·mol−1 |
Heat of Formation |
-623.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.20 ± 1.08 D |
Volume |
576.1 Å 3 |
Surface Area |
433.59 Å 2 |
HOMO Energy |
-9.00 ± 0.55 eV |
LUMO Energy |
-1.41 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2r)-1-[(2s)-3-(3-amidinophenyl)-2-(2-naphthylsulfonylamino)propanoyl]pipecolinic acid
- (2r)-1-[(2s)-3-(3-carbamimidoylphenyl)-2-(2-naphthylsulfonylamino)-1-oxopropyl]-2-piperidinecarboxylic acid
- (2r)-1-[(2s)-3-(3-carbamimidoylphenyl)-2-(2-naphthylsulfonylamino)propanoyl]piperidine-2-carboxylic acid
- (2r)-1-[(2s)-3-(3-carbamimidoylphenyl)-2-(naphthalen-2-ylsulfonylamino)propanoyl]piperidine-2-carboxylic acid
- fd1
- n-alpha-(2-naphthylsulfonyl)-n-(3-amidino-l-phenylalaninyl)-d-pipecolinic acid
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InChIKey |
GNANSBQAIRJZPA-XZOQPEGZSA-N |
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Elements |
H
C
S
O
N
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