Basic information
- Standard SMILES
CCCC1CCC(N2CC(NC(=O)CNc3noc4ccc(C(F)(F)F)cc34)C2)CC1- InChIKey
ZSIVGIONKGFBBL-UHFFFAOYSA-N- Molecular formula
- C22H29F3N4O2
- Average molar mass
- 438.5 g/mol
Names & identifiers
- Preferred name
- N-[1-(4-Propyl-cyclohexyl)-azetidin-3-yl]-2-(5-trifluoromethyl-benzo[d]isoxazol-3-ylamino)-acetamide
- IUPAC
- N-[1-(4-propylcyclohexyl)azetidin-3-yl]-2-[[5-(trifluoromethyl)-1,2-benzoxazol-3-yl]amino]acetamide
Names & synonyms
N-[1-(4-Propyl-cyclohexyl)-azetidin-3-yl]-2-(5-trifluoromethyl-benzo[d]isoxazol-3-ylamino)-acetamideSCHEMBL2634558SCHEMBL16512232
Database identifiers
- PubChem CID
- 54756155
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 70.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 606
Related reactions
2 records
Compound notes
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