Formula |
C41H49N7O4S |
IUPAC Name |
(2r)-n-[(1s)-1-benzyl-2-oxo-2-(2-phenylethylamino)ethyl]-5-guanidino-2-[[(2r)-3-methylsulfanyl-2-[[2-(4-phenylphenyl)acetyl]amino]propanoyl]amino]pentanamide |
Molecular Mass |
735.937 g·mol−1 |
Heat of Formation |
-355.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.70 ± 1.08 D |
Volume |
915.79 Å 3 |
Surface Area |
755.08 Å 2 |
HOMO Energy |
-8.53 ± 0.55 eV |
LUMO Energy |
-0.37 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2r)-5-(diaminomethylideneamino)-2-[[(2r)-3-methylsulfanyl-2-[2-(4-phenylphenyl)ethanoylamino]propanoyl]amino]-n-[(2s)-1-oxo-3-phenyl-1-(2-phenylethylamino)propan-2-yl]pentanamide
- (2r)-5-(diaminomethylideneamino)-2-[[(2r)-3-methylsulfanyl-2-[[2-(4-phenylphenyl)acetyl]amino]propanoyl]amino]-n-[(2s)-1-oxo-3-phenyl-1-(2-phenylethylamino)propan-2-yl]pentanamide
- (2r)-5-guanidino-2-[[(2r)-3-(methylthio)-1-oxo-2-[[1-oxo-2-(4-phenylphenyl)ethyl]amino]propyl]amino]-n-[(1s)-2-oxo-2-(2-phenylethylamino)-1-(phenylmethyl)ethyl]pentanamide
- (2r)-5-guanidino-2-[[(2r)-3-methylsulfanyl-2-[[2-(4-phenylphenyl)acetyl]amino]propanoyl]amino]-n-[(1s)-2-oxo-2-(2-phenylethylamino)-1-(phenylmethyl)ethyl]pentanamide
- (2r)-n-[(1s)-1-(benzyl)-2-keto-2-(2-phenylethylamino)ethyl]-5-guanidino-2-[[(2r)-3-(methylthio)-2-[[2-(4-phenylphenyl)acetyl]amino]propanoyl]amino]valeramide
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InChIKey |
UYRQVAFRIYOHSH-SBPNQFBHSA-N |
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