Basic information
- CAS
79571-55-4- Standard SMILES
O=[N+]([O-])c1ccc(-c2csc(Nc3ccccn3)n2)o1- InChIKey
SPGVIIBDOMJNRJ-UHFFFAOYSA-N- Molecular formula
- C12H8N4O3S
- Average molar mass
- 288.28 g/mol
- Monoisotopic mass
- 288.0317113
Names & identifiers
- Preferred name
- N-[4-(5-Nitrofuran-2-yl)-1,3-thiazol-2-yl]pyridin-2-amine
- IUPAC
- 4-(5-nitrofuran-2-yl)-N-pyridin-2-yl-1,3-thiazol-2-amine
Names & synonyms
NSC35368079571-55-4DTXSID70320005N-[4-(5-Nitrofuran-2-yl)-1,3-thiazol-2-yl]pyridin-2-amineNSC-3536804-(5-nitro-2-furyl)-N-(2-pyridyl)thiazol-2-amineN-[4-(5-nitro-2-furyl)-1,3-thiazol-2-yl]pyridin-2-amine
Database identifiers
- CAS
79571-55-4- PubChem CID
- 337060
- DTXSID
DTXSID70320005
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 354
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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