Ro 24-5098
Basic information
- CAS
127682-75-1- Standard SMILES
Nc1ncnc2c1ncn2[C@H]1CO[C@@H](CO)C1- InChIKey
FJKGKWDFDNULCJ-RNFRBKRXSA-N- Molecular formula
- C10H13N5O2
- Average molar mass
- 235.24 g/mol
- Monoisotopic mass
- 235.10692467
Overview
structure given in first source; has anti-HIV activity
Names & identifiers
- Preferred name
- Ro 24-5098
- IUPAC
- [(2R,4R)-4-(6-aminopurin-9-yl)oxolan-2-yl]methanol
- English name
- Ro 24-5098
- Molecular formula
- C10H13N5O2
- Molecular weight
- 235.24252
Names & synonyms
Ro 24-5098127682-75-1ro24-5098Ro-24-5098DTXSID40155624RefChem:179650DTXCID5078115Isodda[(2R,4R)-4-(6-aminopurin-9-yl)oxolan-2-yl]methanolL-threo-Pentitol, 2-(6-amino-9H-purin-9-yl)-1,4-anhydro-2,3-dideoxy-Iso-ddACHEMBL421506
Show more names
Ro 24 5098,Ro 245098
orb1699491SCHEMBL9679986FJKGKWDFDNULCJ-RNFRBKRXSA-N((2R,4R)-4-(6-amino-9H-purin-9-yl)tetrahydrofuran-2-yl)methanolAKOS040749330CS-0086195T28575[(2R,4R)-4-(6-aminopurin-9-yl)tetrahydrofuran-2-yl]methanol
Database identifiers
- CAS
127682-75-1- PubChem CID
- 124453
- DTXSID
DTXSID40155624- ChEMBL
CHEMBL421506- Nikkaji
- J473.885C
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 99.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 279
Chemistry & industry
Applications
DescriptionRo 24-5098 is an anti-HIV inhibitory effects of isoddA pronucleotides.
UsesRo24-5098 is an active compound.
Related reactions
1 records
Compound notes
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