Basic information
- Standard SMILES
CNC(=O)c1c(-c2ccc(F)cc2)oc2nc(N(C)S(C)(=O)=O)c(-c3ccc4c(n3)-c3cc5c(F)cccc5n3CC4)cc12- InChIKey
QSDUWEZFRCKLHN-UHFFFAOYSA-N- Molecular formula
- C32H25F2N5O4S
- Average molar mass
- 613.6 g/mol
- Monoisotopic mass
- 613.15953179
Names & identifiers
- Preferred name
- 5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-2-(4-fluorophenyl)-N-methyl-6-(N-methylmethylsulfonamido)furo[2,3-b]pyridine-3-carboxamide
- IUPAC
- 5-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-2-(4-fluorophenyl)-N-methyl-6-[methyl(methylsulfonyl)amino]furo[2,3-b]pyridine-3-carboxamide
Names & synonyms
CHEMBL3939908SCHEMBL15951075QSDUWEZFRCKLHN-UHFFFAOYSA-NBDBM204674US9243002, 455-(11-fluoro-5,6-dihydroindolo[1,2-h][1,7]naphthyridin-2-yl)-2-(4-fluorophenyl)-N-methyl-6-(N-methylmethylsulfonamido)furo[2,3-b]pyridine-3-carboxamide
Database identifiers
- PubChem CID
- 77845926
- ChEMBL
CHEMBL3939908
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 1,170
Related reactions
1 records
Compound notes
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