Basic information
- Standard SMILES
O=c1[nH]c2nc(OCCCCN3CCN(c4cccc5ccccc45)CC3)ccc2cc1F- InChIKey
YYXBPHXCZMKKBM-UHFFFAOYSA-N- Molecular formula
- C26H27FN4O2
- Average molar mass
- 446.5 g/mol
- Monoisotopic mass
- 446.21180428
Names & identifiers
- Preferred name
- 3-Fluoro-7-[4-(4-naphthalen-1-yl-piperazin-1-yl)-butoxy]-1h-[1,8]naphthyridin-2-one
- IUPAC
- 3-fluoro-7-[4-(4-naphthalen-1-ylpiperazin-1-yl)butoxy]-1H-1,8-naphthyridin-2-one
Names & synonyms
SCHEMBL5363681YYXBPHXCZMKKBM-UHFFFAOYSA-N3-Fluoro-7-[4-(4-naphthalen-1-vl-piperazin-1 -yl)-butoxy]-1H-[1,8]naphthyridin-2-one3-fluoro-7-[4-(4-naphthalen-1-yl-piperazin-1-yl)-butoxy]-1h-[1,8]naphthyridin-2-one
Database identifiers
- PubChem CID
- 21073302
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 57.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 696
Related reactions
1 records
Compound notes
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