10-N-(Bromoacetyl)amino-1-decylglucopyranoside
2-bromo-N-[10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxydecyl]acetamide
Also Known As: BADG|10-N-(Bromoacetyl)amino-1-decylglucopyranoside|Acetamide, 2-bromo-N-(10-(beta-D-glucopyranosyloxy)decyl)-, (R)-|10-N-(Bromoacetyl)amino-1-decyl-beta-D-glucopyranoside|2-bromo-n-[10-(|A-d-glucopyranosyloxy)decyl]acetamide|2-Bromo-N-[10-(hexopyranosyloxy)decyl]ethanimidic acid|2-bromo-N-[10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxydecyl]acetamide|Bromo-N-[10-(beta-D-glucopyranosyloxy)decyl]ethanimidic acid
| Molecular Formula | C18H34BrNO7 |
|---|---|
| Molecular Weight | 455.15186 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 14 |
| Exact Mass | 455.15186 |
| Monoisotopic Mass | 455.15186 |
| Heavy Atoms | 27 |
| Complexity | 402.0 |
Chemical Identifiers
| CAS Number | 2532-07-2 |
|---|---|
| SMILES | C(CCCCCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)CCCCNC(=O)CBr |
| InChIKey | HPKOGOXSZACZEZ-SOVHRIKKSA-N |
Product Overview
10-N-(Bromoacetyl)amino-1-decylglucopyranoside (CAS 2532-07-2), with molecular formula C18H34BrNO7 and molecular weight 455.15186 g/mol. IUPAC: 2-bromo-N-[10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxydecyl]acetamide.