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Basic information
- Standard SMILES
Nc1ncc([N+](=O)[O-])c(-n2ncc3ccc(I)cc32)n1- InChIKey
QXMJJBUZRPSVSU-UHFFFAOYSA-N- Molecular formula
- C11H7IN6O2
- Average molar mass
- 382.12 g/mol
Names & identifiers
- Preferred name
- 4-(6-iodo-1H-indazol-1-yl)-5-nitropyrimidin-2-amine
- IUPAC
- 4-(6-iodoindazol-1-yl)-5-nitropyrimidin-2-amine
Names & synonyms
4-(6-iodo-1H-indazol-1-yl)-5-nitropyrimidin-2-amineSCHEMBL11971154QXMJJBUZRPSVSU-UHFFFAOYSA-NDB-1375651394119-43-7
Database identifiers
- PubChem CID
- 68181981
Properties
Computed structural propertiesFilling in
- XLogP
- 2
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 380
Related reactions
2 records
Compound notes
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