3-[(4-fluorophenyl)methyl]-4-oxo-N-[2-(trifluoromethyl)phenyl]-3,4-dihydrospiro[[1,3]benzoxazine-2,4'-piperidine]-1'-carboxamide
Chemical Structure Depiction of
3-[(4-fluorophenyl)methyl]-4-oxo-N-[2-(trifluoromethyl)phenyl]-3,4-dihydrospiro[[1,3]benzoxazine-2,4'-piperidine]-1'-carboxamide
3-[(4-fluorophenyl)methyl]-4-oxo-N-[2-(trifluoromethyl)phenyl]-3,4-dihydrospiro[[1,3]benzoxazine-2,4'-piperidine]-1'-carboxamide
Compound characteristics
| Compound ID: | E002-1725 |
| Compound Name: | 3-[(4-fluorophenyl)methyl]-4-oxo-N-[2-(trifluoromethyl)phenyl]-3,4-dihydrospiro[[1,3]benzoxazine-2,4'-piperidine]-1'-carboxamide |
| Molecular Weight: | 513.49 |
| Molecular Formula: | C27 H23 F4 N3 O3 |
| Smiles: | C1CN(CCC12N(Cc1ccc(cc1)F)C(c1ccccc1O2)=O)C(Nc1ccccc1C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2075 |
| logD: | 5.2075 |
| logSw: | -5.279 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.225 |
| InChI Key: | IPUCHGRAMMWNQR-UHFFFAOYSA-N |