3-(2,2-dimethylpropanamido)-N-[(4-fluorophenyl)methyl]-N-[(pyridin-3-yl)methyl]-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
3-(2,2-dimethylpropanamido)-N-[(4-fluorophenyl)methyl]-N-[(pyridin-3-yl)methyl]-1-benzofuran-2-carboxamide
3-(2,2-dimethylpropanamido)-N-[(4-fluorophenyl)methyl]-N-[(pyridin-3-yl)methyl]-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | E957-2196 |
| Compound Name: | 3-(2,2-dimethylpropanamido)-N-[(4-fluorophenyl)methyl]-N-[(pyridin-3-yl)methyl]-1-benzofuran-2-carboxamide |
| Molecular Weight: | 459.52 |
| Molecular Formula: | C27 H26 F N3 O3 |
| Smiles: | CC(C)(C)C(Nc1c2ccccc2oc1C(N(Cc1ccc(cc1)F)Cc1cccnc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7733 |
| logD: | 3.7519 |
| logSw: | -3.709 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.189 |
| InChI Key: | MAXIMNXSMZVYLT-UHFFFAOYSA-N |