6-ethyl-7-hydroxy-4-{[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-ethyl-7-hydroxy-4-{[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
6-ethyl-7-hydroxy-4-{[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-3824 |
| Compound Name: | 6-ethyl-7-hydroxy-4-{[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C25 H28 N2 O3 |
| Smiles: | CCc1cc2C(CN3CCN(CC3)C/C=C/c3ccccc3)=CC(=O)Oc2cc1O |
| Stereo: | ACHIRAL |
| logP: | 3.7715 |
| logD: | 3.6072 |
| logSw: | -3.5742 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.445 |
| InChI Key: | LLTIILJSUUKCDL-UHFFFAOYSA-N |