Basic information
- Standard SMILES
Cc1cn2c(nc1=O)O[C@H]1C[C@H]2O[C@@H]1CO- InChIKey
JCSNHEYOIASGKU-XLPZGREQSA-N- Molecular formula
- C10H12N2O4
- Average molar mass
- 224.21 g/mol
Names & identifiers
- Preferred name
- 2,3'-Anhydrothymidine
- IUPAC
- (1R,9S,10R)-10-(hydroxymethyl)-4-methyl-8,11-dioxa-2,6-diazatricyclo[7.2.1.02,7]dodeca-3,6-dien-5-one
Names & synonyms
2,3'-ANHYDROTHYMIDINECHEMBL1269502JCSNHEYOIASGKU-XLPZGREQSA-NAKOS030241891SR-01000402001SR-01000402001-1
Database identifiers
- PubChem CID
- 6915752
- ChEMBL
CHEMBL1269502- Nikkaji
- J1.909.078G
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 71.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 404
Related reactions
23 records
Compound notes
Loading…