Formula |
C17H18BrNO4S |
IUPAC Name |
(2s)-2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-3-methyl-butanoic acid |
Molecular Mass |
412.298 g·mol−1 |
Heat of Formation |
-566.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.78 ± 1.08 D |
Volume |
420.99 Å 3 |
Surface Area |
364.06 Å 2 |
HOMO Energy |
-9.67 ± 0.55 eV |
LUMO Energy |
-1.02 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-3-methyl-butanoic acid
- (2s)-2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-3-methyl-butyric acid
- (2s)-2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-3-methylbutanoic acid
- (s)-2-(4′-bromo-biphenyl-4-sulfonylamino-3-methylbutyric acid)
- mmp-2/mmp-3 inhibitor iii, pd166793
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InChIKey |
GJOCABIDMCKCEG-INIZCTEOSA-N |
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Links |
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DOI |
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Elements |
C
H
O
N
S
Br
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