4-[(4-benzylpiperazin-1-yl)methyl]-N-cyclopentyl-5-hydroxy-2-methyl-1-benzofuran-3-carboxamide
Chemical Structure Depiction of
4-[(4-benzylpiperazin-1-yl)methyl]-N-cyclopentyl-5-hydroxy-2-methyl-1-benzofuran-3-carboxamide
4-[(4-benzylpiperazin-1-yl)methyl]-N-cyclopentyl-5-hydroxy-2-methyl-1-benzofuran-3-carboxamide
Compound characteristics
| Compound ID: | D089-0531 |
| Compound Name: | 4-[(4-benzylpiperazin-1-yl)methyl]-N-cyclopentyl-5-hydroxy-2-methyl-1-benzofuran-3-carboxamide |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C27 H33 N3 O3 |
| Smiles: | Cc1c(C(NC2CCCC2)=O)c2c(CN3CCN(CC3)Cc3ccccc3)c(ccc2o1)O |
| Stereo: | ACHIRAL |
| logP: | 3.876 |
| logD: | 3.6862 |
| logSw: | -4.1428 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.512 |
| InChI Key: | SHZVTFMFLSTVAW-UHFFFAOYSA-N |