Basic information
- CAS
146609-12-3- Standard SMILES
Nc1ccn([C@@H]2C[C@H](CO)CO2)c(=O)n1- InChIKey
FDDOMDNFGMBWIL-SVRRBLITSA-N- Molecular formula
- C9H13N3O3
- Average molar mass
- 211.22 g/mol
- Monoisotopic mass
- 211.09569129
Names & identifiers
- Preferred name
- beta-2'-Oxa-carbocyclic-2',3'-dideoxycytidine
- IUPAC
- 4-amino-1-[(2S,4R)-4-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
Names & synonyms
146609-12-3beta-2'-Oxa-carbocyclic-2',3'-dideoxycytidineDTXSID801634202(1H)-Pyrimidinone, 4-amino-1-(tetrahydro-4-(hydroxymethyl)-2-furanyl)-, (2S,4R)-2(1H)-Pyrimidinone, 4-amino-1-[tetrahydro-4-(hydroxymethyl)-2-furanyl]-, (2S,4R)-RefChem:328892DTXCID4085911.beta.-2'-Oxa-carbocyclic-2',3'-dideoxycytidine4-Amino-1-[(2S,4R)-4-(hydroxymethyl)oxolan-2-yl]pyrimidin-2(1H)-one4-amino-1-[(2S,4R)-4-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2-one4-Amino-1-((2S,4R)-4-(hydroxymethyl)tetrahydrofuran-2-yl)pyrimidin-2(1H)-one
Database identifiers
- CAS
146609-12-3- PubChem CID
- 452807
- DTXSID
DTXSID80163420
Properties
Computed structural properties
- XLogP
- -1.4
- Topological polar surface area
- 88.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 327
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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