5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate
[(2R,3R,4R,5R)-2-(5,6-dichlorobenzimidazol-1-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl] dihydrogen phosphate
Also Known As: Dcrfb 2'-phosphate|Dcrfb-2'-monophosphate|5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate|5,6-dichloro-1- benzimidazole2'-phosphate|Dichlororibofuranosylbenzimidazole 2'-monophosphate|[(2R,3R,4R,5R)-2-(5,6-dichlorobenzimidazol-1-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl] dihydrogen phosphate|1H-Benzimidazole, 5,6-dichloro-1-(2-O-phosphono-beta-D-ribofuranosyl)-|5,6-Dichloro-1-(2-O-phosphono-beta-D-ribofuranosyl)-1H-1,3-benzimidazole
| Molecular Formula | C12H13Cl2N2O7P |
|---|---|
| Molecular Weight | 397.98373 g/mol |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 397.98373 |
| Monoisotopic Mass | 397.98373 |
| Heavy Atoms | 24 |
| Complexity | 512.0 |
Chemical Identifiers
| CAS Number | 75206-89-2 |
|---|---|
| SMILES | C1=C2C(=CC(=C1Cl)Cl)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)OP(=O)(O)O |
| InChIKey | XSKLIPONBPTDBE-DDHJBXDOSA-N |
Product Overview
5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate (CAS 75206-89-2), with molecular formula C12H13Cl2N2O7P and molecular weight 397.98373 g/mol. IUPAC: [(2R,3R,4R,5R)-2-(5,6-dichlorobenzimidazol-1-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl] dihydrogen phosphate.