Basic information
- Standard SMILES
CC(=O)OC[C@H]1O[C@@H](n2c(=O)sc3c(Cl)nc(Cl)nc32)[C@H](OC(C)=O)[C@@H]1OC(C)=O- InChIKey
JRPSVXOMGMAOQB-NZHONMPCSA-N- Molecular formula
- C16H15Cl2N3O8S
- Average molar mass
- 480.3 g/mol
- Monoisotopic mass
- 478.995691
Names & identifiers
- Preferred name
- 5,7-Dichloro-3-(2,3,5-tri-O-acetyl-beta-D-ribofuranosyl)thiazolo[4,5-d]pyrimidin-2-one
- IUPAC
- [(2R,3R,4R,5R)-3,4-diacetyloxy-5-(5,7-dichloro-2-oxo-[1,3]thiazolo[4,5-d]pyrimidin-3-yl)oxolan-2-yl]methyl acetate
Names & synonyms
SCHEMBL8662371JRPSVXOMGMAOQB-NZHONMPCSA-N5,7-Dichloro-3-(2,3,5-tri-O-acetyl-beta-D-ribofuranosyl)thiazolo[4,5-d]pyrimidin-2-one
Database identifiers
- PubChem CID
- 53971035
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 160 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 731
Related reactions
2 records
Compound notes
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