Basic information
- CAS
57024-75-6- Standard SMILES
OCC1OC(n2cc(Cl)c3cncnc32)C(O)C1O- InChIKey
WKFYLAZKGLRULX-UHFFFAOYSA-N- Molecular formula
- C11H12ClN3O4
- Average molar mass
- 285.68 g/mol
- Monoisotopic mass
- 285.0516336
Names & identifiers
- Preferred name
- 2-(5-Chloropyrrolo[2,3-d]pyrimidin-7-yl)-5-(hydroxymethyl)oxolane-3,4-diol
- IUPAC
- 2-(5-chloropyrrolo[2,3-d]pyrimidin-7-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Names & synonyms
57024-75-6NSC1666032-(5-chloropyrrolo[2,3-d]pyrimidin-7-yl)-5-(hydroxymethyl)oxolane-3,4-diolDTXSID20304638NSC-1666035-Chloro-7-pentofuranosyl-7H-pyrrolo[2,3-d]pyrimidine
Database identifiers
- CAS
57024-75-6- PubChem CID
- 296446
- DTXSID
DTXSID20304638
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 337
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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