Basic information
- Standard SMILES
COc1cc2c(Nc3cc(O)c(C)cc3F)cnnc2cc1OCCCN1CCOCC1- InChIKey
OAODBUGQAKBDFF-UHFFFAOYSA-N- Molecular formula
- C23H27FN4O4
- Average molar mass
- 442.5 g/mol
Names & identifiers
- Preferred name
- 4-(2-Fluoro-5-hydroxy-4-methylanilino)-6-methoxy-7-(3-morpholinopropoxy)cinnoline
- IUPAC
- 4-fluoro-5-[[6-methoxy-7-(3-morpholin-4-ylpropoxy)cinnolin-4-yl]amino]-2-methylphenol
Names & synonyms
SCHEMBL6097412OAODBUGQAKBDFF-UHFFFAOYSA-N4-(2-fluoro-5-hydroxy-4-methylanilino)-6-methoxy-7-(3-morpholinopropoxy)cinnoline
Database identifiers
- PubChem CID
- 21991044
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 89 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 570
Related reactions
1 records
Compound notes
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