| Formula |
C35H47N5O5S |
| IUPAC Name |
n-[(1s,2r)-1-benzyl-3-[[(1s)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl]amino]-2-hydroxy-propyl]-3-(ethylamino)-5-(n-methylsulfonylanilino)benzamide |
| Molecular Mass |
649.843 g·mol−1 |
| Heat of Formation |
-796.8 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.91 ± 1.08 D |
| Volume |
797.09 Å 3 |
| Surface Area |
628.43 Å 2 |
| HOMO Energy |
-8.59 ± 0.55 eV |
| LUMO Energy |
-0.58 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- n-[(1s,2r)-1-(benzyl)-3-[[(1s)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl]amino]-2-hydroxy-propyl]-3-ethylamino-5-(mesyl-phenyl-amino)benzamide
- n-[(1s,2r)-3-[[(1s)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl]amino]-2-hydroxy-1-(phenylmethyl)propyl]-3-ethylamino-5-(methylsulfonyl-phenyl-amino)benzamide
- n-[(1s,2r)-3-[[(1s)-2-(cyclohexylamino)-1-methyl-2-oxoethyl]amino]-2-hydroxy-1-(phenylmethyl)propyl]-3-ethylamino-5-(methylsulfonyl-phenylamino)benzamide
- n-[(2s,3r)-4-[[(2s)-1-(cyclohexylamino)-1-oxo-propan-2-yl]amino]-3-hydroxy-1-phenyl-butan-2-yl]-3-ethylamino-5-(methylsulfonyl-phenyl-amino)benzamide
- n-[(2s,3r)-4-[[(2s)-1-(cyclohexylamino)-1-oxopropan-2-yl]amino]-3-hydroxy-1-phenylbutan-2-yl]-3-ethylamino-5-(methylsulfonyl-phenylamino)benzamide
|
| InChIKey |
SMMANAWVXZZNER-DZMJNENTSA-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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