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Basic information
- Standard SMILES
Cc1ccc(C(=O)Nc2ccc(Oc3ccc4nc(NC(=O)C5CC5)cn4c3)cn2)[n+]([O-])c1-c1ccc(F)cc1- InChIKey
KJBSIAYJUMRHAW-UHFFFAOYSA-N- Molecular formula
- C29H23FN6O4
- Average molar mass
- 538.5 g/mol
Names & identifiers
- Preferred name
- N-[5-({2-[(cyclopropylcarbonyl)amino]imidazo[1,2-a]pyridin-6-yl}oxy)pyridin-2-yl]-6-(4-fluorophenyl)-5-methylpyridine-2-carboxamide 1-oxide
- IUPAC
- N-[5-[2-(cyclopropanecarbonylamino)imidazo[1,2-a]pyridin-6-yl]oxy-2-pyridinyl]-6-(4-fluorophenyl)-5-methyl-1-oxidopyridin-1-ium-2-carboxamide
Names & synonyms
SCHEMBL1259114KJBSIAYJUMRHAW-UHFFFAOYSA-NN-[5-({2-[(cyclopropylcarbonyl)amino]imidazo[1,2-a]pyridin-6-yl}oxy)pyridin-2-yl]-6-(4-fluorophenyl)-5-methylpyridine-2-carboxamide 1-oxide
Database identifiers
- PubChem CID
- 44595040
Properties
Computed structural propertiesFilling in
- XLogP
- 3.8
- Topological polar surface area
- 123 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 902
Related reactions
2 records
Compound notes
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