N-[(4-bromophenyl)methyl]-1-{5-[2-(2,4-difluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(4-bromophenyl)methyl]-1-{5-[2-(2,4-difluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
N-[(4-bromophenyl)methyl]-1-{5-[2-(2,4-difluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | G637-3772 |
| Compound Name: | N-[(4-bromophenyl)methyl]-1-{5-[2-(2,4-difluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carboxamide |
| Molecular Weight: | 580.45 |
| Molecular Formula: | C25 H24 Br F2 N3 O4 S |
| Smiles: | Cc1c(c(/C=C/c2ccc(cc2F)F)on1)S(N1CCC(CC1)C(NCc1ccc(cc1)[Br])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2738 |
| logD: | 4.2737 |
| logSw: | -4.1881 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.878 |
| InChI Key: | FLBSOTMKFNYRCT-UHFFFAOYSA-N |