2-[1-(2-Carboxypyridin-4-yl)piperidin-4-ylmethylamino]-N-(5-chloropyridin-2-yl)-5-fluorobenzamide
Basic information
- Standard SMILES
O=C(O)c1cc(N2CCC(CNc3ccc(F)cc3C(=O)Nc3ccc(Cl)cn3)CC2)ccn1- InChIKey
GYWOFSPKKLHJSY-UHFFFAOYSA-N- Molecular formula
- C24H23ClFN5O3
- Average molar mass
- 483.9 g/mol
Names & identifiers
- Preferred name
- 2-[1-(2-Carboxypyridin-4-yl)piperidin-4-ylmethylamino]-N-(5-chloropyridin-2-yl)-5-fluorobenzamide
- IUPAC
- 4-[4-[[2-[(5-chloro-2-pyridinyl)carbamoyl]-4-fluoroanilino]methyl]piperidin-1-yl]pyridine-2-carboxylic acid
Names & synonyms
SCHEMBL6108572GYWOFSPKKLHJSY-UHFFFAOYSA-N2-[1-(2-Carboxypyridin-4-yl)piperidin-4-ylmehtylamino]-N-(5-chloropyridin-2-yl)-5-fluorobenzamide2-[1-(2-Carboxypyridin-4-yl)piperidin-4-ylmethylamino]-N-(5-chloropyridin-2-yl)-5-fluorobenzamide
Database identifiers
- PubChem CID
- 21906563
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 696
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Related reactions
3 records
Compound notes
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