N-[2-(2-Fluorophenyl)ethyl]-1-[[2-(1-methyl-1H-pyrazol-4-yl)-4-thiazolyl]carbonyl]-4-piperidinecarboxamide
Basic information
- CAS
1210687-88-9- Standard SMILES
Cn1cc(-c2nc(C(=O)N3CCC(C(=O)NCCc4ccccc4F)CC3)cs2)cn1- InChIKey
WIELFNIOOHUHLD-UHFFFAOYSA-N- Molecular formula
- C22H24FN5O2S
- Average molar mass
- 441.5 g/mol
- Monoisotopic mass
- 441.16347436
Names & identifiers
- Preferred name
- N-[2-(2-Fluorophenyl)ethyl]-1-[[2-(1-methyl-1H-pyrazol-4-yl)-4-thiazolyl]carbonyl]-4-piperidinecarboxamide
- IUPAC
- N-[2-(2-fluorophenyl)ethyl]-1-[2-(1-methylpyrazol-4-yl)-1,3-thiazole-4-carbonyl]piperidine-4-carboxamide
Names & synonyms
DTXSID201110153AKOS0343974791210687-88-9N-[2-(2-Fluorophenyl)ethyl]-1-[[2-(1-methyl-1H-pyrazol-4-yl)-4-thiazolyl]carbonyl]-4-piperidinecarboxamideZ467058614
Database identifiers
- CAS
1210687-88-9- PubChem CID
- 45909660
- DTXSID
DTXSID201110153
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 633
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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