Formula |
C20H19F3N4O5 |
IUPAC Name |
n-[(1s)-1-methyl-2-[[(2s)-2-(4-nitroanilino)propanoyl]amino]-2-oxo-ethyl]-3-(trifluoromethyl)benzamide |
Molecular Mass |
452.384 g·mol−1 |
Heat of Formation |
-1051.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.37 ± 1.08 D |
Volume |
496.36 Å 3 |
Surface Area |
447.72 Å 2 |
HOMO Energy |
-9.19 ± 0.55 eV |
LUMO Energy |
-1.21 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-trifluoromethylbenzoyl-dialanine-4-nitroanilide
- l-alaninamide, n-(3-(trifluoromethyl)benzoyl)-l-alanyl-n-(4-nitrophenyl)-
- m-trifluoromethylbenzoyl-dialanine-p-nitroanilide
- n-[(1s)-1-methyl-2-[[(2s)-2-[(4-nitrophenyl)amino]-1-oxopropyl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide
- n-[(1s)-1-methyl-2-[[(2s)-2-[(4-nitrophenyl)amino]propanoyl]amino]-2-oxo-ethyl]-3-(trifluoromethyl)benzamide
- n-[(1s)-2-keto-1-methyl-2-[[(2s)-2-[(4-nitrophenyl)amino]propanoyl]amino]ethyl]-3-(trifluoromethyl)benzamide
- n-[(2s)-1-[[(2s)-2-[(4-nitrophenyl)amino]propanoyl]amino]-1-oxo-propan-2-yl]-3-(trifluoromethyl)benzamide
- n-[(2s)-1-[[(2s)-2-[(4-nitrophenyl)amino]propanoyl]amino]-1-oxopropan-2-yl]-3-(trifluoromethyl)benzamide
- tfmbdana
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CAS Number(s) |
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InChIKey |
XNZCVNIZILVHGW-RYUDHWBXSA-N |
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Links |
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Elements |
H
C
F
O
N
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