5'-Deoxy-5'-chloroformycin
Basic information
- CAS
72453-27-1- Standard SMILES
Nc1ncnc2c([C@@H]3O[C@H](CCl)[C@@H](O)[C@H]3O)[nH]nc12- InChIKey
YTYTYXVZBHJYMY-KSYZLYKTSA-N- Molecular formula
- C10H12ClN5O3
- Average molar mass
- 285.69 g/mol
- Monoisotopic mass
- 285.062867
Names & identifiers
- Preferred name
- 5'-Deoxy-5'-chloroformycin
- IUPAC
- (2S,3R,4S,5S)-2-(7-amino-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-5-(chloromethyl)oxolane-3,4-diol
- English name
- 5'-deoxy-5'-chloroformycin
- Molecular formula
- C10H12ClN5O3
- Molecular weight
- 285.68698
Names & synonyms
5'-Deoxy-5'-chloroformycin72453-27-1RefChem:1007775'-Deoxy-5'-chloroformycin A(2S,3R,4S,5S)-2-(7-amino-2H-pyrazolo[4,3-d]pyrimidin-3-yl)-5-(chloromethyl)oxolane-3,4-diol2-(7-Amino-1H-pyrazolo[4,3-d]pyrimidin-3-yl)-5-chloromethyl-tetrahydro-furan-3,4-diol(2S,3R,4S,5S)-2-(7-amino-1H-pyrazolo[4,3-d]pyrimidin-3-yl)-5-(chloromethyl)tetrahydrofuran-3,4-diolD-Ribitol, 1-C-(7-amino-1H-pyrazolo(4,3-d)pyrimidin-3-yl)-1,4-anhydro-5-chloro-5-deoxy-, (1S)-
Database identifiers
- CAS
72453-27-1- PubChem CID
- 512709
- Nikkaji
- J735.833D
Properties
Computed structural properties
- XLogP
- -1.5
- Topological polar surface area
- 130 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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