Basic information
- Standard SMILES
COc1nc2ccc(F)cc2nc1NC(=O)N1CCN(c2c(C)cccc2C)CC1- InChIKey
AAVLTWQNAHJPKE-UHFFFAOYSA-N- Molecular formula
- C22H24FN5O2
- Average molar mass
- 409.5 g/mol
- Monoisotopic mass
- 409.19140319
Names & identifiers
- Preferred name
- 1-[(6-Fluoro-2-methoxyquinoxalin-3-yl)aminocarbonyl]-4-(2,6-dimethylphenyl)piperazine
- IUPAC
- 4-(2,6-dimethylphenyl)-N-(7-fluoro-3-methoxyquinoxalin-2-yl)piperazine-1-carboxamide
Names & synonyms
SCHEMBL4927017AAVLTWQNAHJPKE-UHFFFAOYSA-N1-[(6-Fluoro-2-methoxyquinoxalin-3-yl)aminocarbonyl]-4-(2,6-dimethylphenyl)piperazine
Database identifiers
- PubChem CID
- 11582272
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 70.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 578
Related reactions
3 records
Linked notes
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