Basic information
- CAS
897016-27-2- Standard SMILES
CC(C)COc1cc(F)cc(CNC(=O)Cc2ccc(-c3ccc(N4CCOCC4)cc3)cn2)c1- InChIKey
YSXBQUOCHATEDJ-UHFFFAOYSA-N- Molecular formula
- C28H32FN3O3
- Average molar mass
- 477.6 g/mol
- Monoisotopic mass
- 477.24277005
Names & identifiers
- Preferred name
- N-[[3-Fluoro-5-(2-methylpropoxy)phenyl]methyl]-5-[4-(4-morpholinyl)phenyl]-2-pyridineacetamide
- IUPAC
- N-[[3-fluoro-5-(2-methylpropoxy)phenyl]methyl]-2-[5-(4-morpholin-4-ylphenyl)-2-pyridinyl]acetamide
Names & synonyms
SCHEMBL10084850DTXSID601118692897016-27-2N-[[3-Fluoro-5-(2-methylpropoxy)phenyl]methyl]-5-[4-(4-morpholinyl)phenyl]-2-pyridineacetamideN-{[3-Fluoro-5-(2-methylpropoxy)phenyl]methyl}-2-{5-[4-(morpholin-4-yl)phenyl]pyridin-2-yl}acetamide
Database identifiers
- CAS
897016-27-2- PubChem CID
- 11655901
- DTXSID
DTXSID601118692
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 63.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 637
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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