Basic information
- Standard SMILES
COc1ccc(CN2Cc3c(Oc4ccc5c(NC(=O)c6cccn(-c7ccc(F)cc7)c6=O)nn(C)c5c4)ccnc3NC2=O)cc1- InChIKey
WPNISBVTTAACQY-UHFFFAOYSA-N- Molecular formula
- C35H28FN7O5
- Average molar mass
- 645.6 g/mol
- Monoisotopic mass
- 645.21359518
Names & identifiers
- Preferred name
- 1-(4-Fluoro-phenyl)-2-oxo-1,2-dihydro-pyridine-3-carboxylicacid{6-[3-(4-methoxy-benzyl)-2-oxo-1,2,3,4-tetrahydro-pyrido[2,3-d]pyrimidin-5-yloxy]-1-methyl-1H-indazol-3-yl}-amide
- IUPAC
- 1-(4-fluorophenyl)-N-[6-[[3-[(4-methoxyphenyl)methyl]-2-oxo-1,4-dihydropyrido[2,3-d]pyrimidin-5-yl]oxy]-1-methylindazol-3-yl]-2-oxopyridine-3-carboxamide
Names & synonyms
SCHEMBL11027298WPNISBVTTAACQY-UHFFFAOYSA-N1-(4-Fluoro-phenyl)-2-oxo-1,2-dihydro-pyridine-3-carboxylicacid{6-[3-(4-methoxy-benzyl)-2-oxo-1,2,3,4-tetrahydro-pyrido[2,3-d]pyrimidin-5-yloxy]-1-methyl-1H-indazol-3-yl}-amide
Database identifiers
- PubChem CID
- 70497011
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 131 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 48
- Formal charge
- 0
- Complexity
- 1,250
Related reactions
2 records
Compound notes
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