Basic information
- Standard SMILES
COc1cc2nccc(Oc3ccc(NC(=O)c4c[nH]c(=O)n(-c5ccc(F)cc5)c4=O)cc3OC)c2cc1OC- InChIKey
QJVCWBBLLLQQNF-UHFFFAOYSA-N- Molecular formula
- C29H23FN4O7
- Average molar mass
- 558.5 g/mol
Names & identifiers
- Preferred name
- 3-(4-Fluoro-phenyl)-2,4-dioxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid [4-(6,7-dimethoxy-quinolin-4-yloxy)-3-methoxy-phenyl]-amide
- IUPAC
- N-[4-(6,7-dimethoxyquinolin-4-yl)oxy-3-methoxyphenyl]-3-(4-fluorophenyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide
Names & synonyms
CHEMBL6057383SCHEMBL16092625QJVCWBBLLLQQNF-UHFFFAOYSA-N3-(4-Fluoro-phenyl)-2,4-dioxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxyl ic acid [4-(6,7-dimethoxy-quinolin-4-yloxy)-3-methoxy-phenyl]-amide3-(4-Fluoro-phenyl)-2,4-dioxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid [4-(6,7-dimethoxy-quinolin-4-yloxy)-3-methoxy-phenyl]-amide
Database identifiers
- PubChem CID
- 90454906
- ChEMBL
CHEMBL6057383
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 128 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 990
Related reactions
2 records
Compound notes
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