4-Thiazolecarboxamide,5-O-phosphinico-beta-D-ribofuranosyl)-, monosodium salt
Basic information
- CAS
87842-99-7- Standard SMILES
NC(=O)c1csc(C2OC3COP(=O)(O)OC3C2O)n1.[Na+]- InChIKey
LWCMUZRCUMAYDX-UHFFFAOYSA-N- Molecular formula
- C9H11N2NaO7PS+
- Average molar mass
- 345.22 g/mol
- Monoisotopic mass
- 344.99222815
Names & identifiers
- Preferred name
- 4-Thiazolecarboxamide,5-O-phosphinico-beta-D-ribofuranosyl)-, monosodium salt
- IUPAC
- sodium 2-(2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl)-1,3-thiazole-4-carboxamide
Names & synonyms
87842-99-7NSC359276DTXSID50712707NSC-3592764-Thiazolecarboxamide,5-O-phosphinico-.beta.-D-ribofuranosyl)-, monosodium saltsodium;2-(2,7-dihydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl)-1,3-thiazole-4-carboxamide
Database identifiers
- CAS
87842-99-7- PubChem CID
- 54599306
- DTXSID
DTXSID50712707
Properties
Computed structural properties
- Topological polar surface area
- 169 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 1
- Complexity
- 466
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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