Isothiazolo[4,3-(beta-D-ribofuranosyl)-
Basic information
- CAS
155666-65-2- Standard SMILES
Nc1ncnc2c(C3OC(CO)C(O)C3O)nsc12- InChIKey
YGFGQYZYMXRMTP-UHFFFAOYSA-N- Molecular formula
- C10H12N4O4S
- Average molar mass
- 284.29 g/mol
- Monoisotopic mass
- 284.05792605
Names & identifiers
- Preferred name
- Isothiazolo[4,3-(beta-D-ribofuranosyl)-
- IUPAC
- 2-(7-amino-[1,2]thiazolo[4,5-d]pyrimidin-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Names & synonyms
NSC675865155666-65-2NSC675866NSC-675865SCHEMBL3957194CHEMBL1978478DTXSID00327668NSC-675866NCI60_026785NCI60_026786Isothiazolo[4,3-(.beta.-D-ribofuranosyl)-D-Ribitol,5-d]pyrimidin-3-yl)-1,4-anhydro-
Show more names
1-(7-Aminoisothiazolo[4,5-d]pyrimidin-3-yl)-1,4-anhydropentitol1-(7-Amino[1,2]thiazolo[4,5-d]pyrimidin-3-yl)-1,4-anhydropentitolD-Ribitol, 1-C-(7-aminoisothiazolo[4,5-d]pyrimidin-3-yl)-1,4-anhydro-, (1S)-
Database identifiers
- CAS
155666-65-2- PubChem CID
- 385012
- DTXSID
DTXSID00327668- ChEMBL
CHEMBL1978478
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 163 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 339
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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