Basic information
- CAS
73768-59-9- Standard SMILES
NC(=O)c1cc([N+](=O)[O-])cnc1Sc1ncccn1- InChIKey
XOUGNVDLEQFPDS-UHFFFAOYSA-N- Molecular formula
- C10H7N5O3S
- Average molar mass
- 277.26 g/mol
- Monoisotopic mass
- 277.02696028
Names & identifiers
- Preferred name
- 3-Pyridinecarboxamide, 5-nitro-2-(2-pyrimidinylthio)-
- IUPAC
- 5-nitro-2-pyrimidin-2-ylsulfanylpyridine-3-carboxamide
Names & synonyms
73768-59-9NSC 3252885-Nitro-2-(pyrimidin-2-ylthio)nicotinamide3-Pyridinecarboxamide, 5-nitro-2-(2-pyrimidinylthio)-NSC325288NSC-3252885-nitro-2-pyrimidin-2-ylsulfanyl-pyridine-3-carboxamide5-nitro-2-(pyrimidin-2-ylsulfanyl)pyridine-3-carboxamide6CY336FFK6DTXSID60224129DS-0155055-nitro-2-(2-pyrimidinylsulfanyl)nicotinamide
Show more names
AJ-333/092130175-Nitro-2-(2-pyrimidinylthio)-3-pyridinecarboxamide5-Nitro-2-[(pyrimidin-2-yl)sulfanyl]pyridine-3-carboxamide
Database identifiers
- CAS
73768-59-9- PubChem CID
- 72671
- DTXSID
DTXSID60224129- UNII
- 6CY336FFK6
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 153 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 345
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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