4-[(azepan-1-yl)methyl]-N-(2,4-dimethylphenyl)-5-hydroxy-2-methyl-1-benzofuran-3-carboxamide
Chemical Structure Depiction of
4-[(azepan-1-yl)methyl]-N-(2,4-dimethylphenyl)-5-hydroxy-2-methyl-1-benzofuran-3-carboxamide
4-[(azepan-1-yl)methyl]-N-(2,4-dimethylphenyl)-5-hydroxy-2-methyl-1-benzofuran-3-carboxamide
Compound characteristics
| Compound ID: | D089-0546 |
| Compound Name: | 4-[(azepan-1-yl)methyl]-N-(2,4-dimethylphenyl)-5-hydroxy-2-methyl-1-benzofuran-3-carboxamide |
| Molecular Weight: | 406.52 |
| Molecular Formula: | C25 H30 N2 O3 |
| Smiles: | Cc1ccc(c(C)c1)NC(c1c2c(CN3CCCCCC3)c(ccc2oc1C)O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3896 |
| logD: | 4.5099 |
| logSw: | -5.2529 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.191 |
| InChI Key: | MKMRGAPTCYHHJH-UHFFFAOYSA-N |