4-amino-5-bromo-1-pentofuranosylpyrimidin-2(1H)-one
4-amino-5-bromo-1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
Also Known As: 5-bromocytidine|ChemDiv1_027597|Oprea1_252483|1H-pyrazolo[3,4-b]pyridine|HMS665G09|SR-01000518963-1|4-amino-5-bromo-1-pentofuranosylpyrimidin-2(1H)-one|A1730/0073571|4-AMINO-5-BROMO-1-[(2R,3R,4S,5R)-3,4-DIHYDROXY-5-(HYDROXYMETHYL)OXOLAN-2-YL]PYRIMIDIN-2-ONE|4-amino-5-bromo-1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one|4-amino-5-bromo-1-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2-one|6-amino-3-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-bromo-3-hydropyrimidi n-2-one
| Molecular Formula | C9H12BrN3O5 |
|---|---|
| Molecular Weight | 320.99603 g/mol |
| LogP | -1.8005 |
| Topological Polar Surface Area | 130.83 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 320.99603 |
| Monoisotopic Mass | 320.99603 |
| Heavy Atoms | 18 |
| Complexity | 507.46674 |
Chemical Identifiers
| CAS Number | 3066-86-2 |
|---|---|
| SMILES | C1=C(C(=NC(=O)N1C2C(C(C(O2)CO)O)O)N)Br |
Product Overview
4-amino-5-bromo-1-pentofuranosylpyrimidin-2(1H)-one (CAS 3066-86-2), with molecular formula C9H12BrN3O5 and molecular weight 320.99603 g/mol. IUPAC: 4-amino-5-bromo-1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one.