Basic information
- Standard SMILES
CCOC(=O)c1cn(N2CCOCC2)c2ccc(CN3CCOCC3)cc2c1=O- InChIKey
PWVKWBFYQUUCBH-UHFFFAOYSA-N- Molecular formula
- C21H27N3O5
- Average molar mass
- 401.5 g/mol
- Monoisotopic mass
- 401.19507097
Names & identifiers
- Preferred name
- Ethyl 1-(4-morpholinyl)-6-(4-morpholinylmethyl)-4-oxo-1,4-dihydro-3-quinolinecarboxylate
- IUPAC
- ethyl 1-morpholin-4-yl-6-(morpholin-4-ylmethyl)-4-oxoquinoline-3-carboxylate
Names & synonyms
SCHEMBL7929460PWVKWBFYQUUCBH-UHFFFAOYSA-NEthyl 1-(4-morpholinyl)-6-(4-morpholinylmethyl)-4-oxo-1,4-dihydro-3-quinolinecarboxylate
Database identifiers
- PubChem CID
- 21192510
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 71.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 628
Related reactions
3 records
Compound notes
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