4,5-Dihydroxy-1-(5-nitro-2-thiazolyl)-2-imidazolidinone
Basic information
- CAS
72589-87-8- Standard SMILES
O=C1NC(O)C(O)N1c1ncc([N+](=O)[O-])s1- InChIKey
RPLQGEUBCBYNQA-UHFFFAOYSA-N- Molecular formula
- C6H6N4O5S
- Average molar mass
- 246.2 g/mol
- Monoisotopic mass
- 246.00589048
Names & identifiers
- Preferred name
- 4,5-Dihydroxy-1-(5-nitro-2-thiazolyl)-2-imidazolidinone
- IUPAC
- 4,5-dihydroxy-1-(5-nitro-1,3-thiazol-2-yl)imidazolidin-2-one
- English name
- 4,5-Dihydroxy-1-(5-nitro-2-thiazolyl)-2-imidazolidinone
- Molecular formula
- C6H6N4O5S
- Molecular weight
- 0
Names & synonyms
72589-87-84,5-Dihydroxyniridazole4,5-Dihydroxy-1-(5-nitro-2-thiazolyl)-2-imidazolidinone2-IMIDAZOLIDINONE, 4,5-DIHYDROXY-1-(5-NITRO-2-THIAZOLYL)-DTXSID509934381-(5-Nitro-1,3-thiazol-2-yl)-4,5-dihydro-1H-imidazole-2,4,5-triol4,5-dihydroxy-1-(5-nitro-1,3-thiazol-2-yl)imidazolidin-2-one
Database identifiers
- CAS
72589-87-8- PubChem CID
- 51625
- DTXSID
DTXSID50993438- Nikkaji
- J62.590F
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 160 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 323
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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