4-[(4-benzylpiperazin-1-yl)methyl]-5-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]-1-benzofuran-3-carboxamide
Chemical Structure Depiction of
4-[(4-benzylpiperazin-1-yl)methyl]-5-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]-1-benzofuran-3-carboxamide
4-[(4-benzylpiperazin-1-yl)methyl]-5-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]-1-benzofuran-3-carboxamide
Compound characteristics
| Compound ID: | D089-0529 |
| Compound Name: | 4-[(4-benzylpiperazin-1-yl)methyl]-5-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]-1-benzofuran-3-carboxamide |
| Molecular Weight: | 523.56 |
| Molecular Formula: | C29 H28 F3 N3 O3 |
| Smiles: | Cc1c(C(Nc2cccc(c2)C(F)(F)F)=O)c2c(CN3CCN(CC3)Cc3ccccc3)c(ccc2o1)O |
| Stereo: | ACHIRAL |
| logP: | 5.5607 |
| logD: | 5.3709 |
| logSw: | -5.6873 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.098 |
| InChI Key: | PTQNDXJBEWNYAJ-UHFFFAOYSA-N |