7-{2-hydroxy-3-[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]propoxy}-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-{2-hydroxy-3-[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]propoxy}-4-methyl-2H-1-benzopyran-2-one
7-{2-hydroxy-3-[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]propoxy}-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y041-4508 |
| Compound Name: | 7-{2-hydroxy-3-[4-(3-phenylprop-2-en-1-yl)piperazin-1-yl]propoxy}-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 434.53 |
| Molecular Formula: | C26 H30 N2 O4 |
| Smiles: | CC1=CC(=O)Oc2cc(ccc12)OCC(CN1CCN(CC1)C/C=C/c1ccccc1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4107 |
| logD: | 3.2154 |
| logSw: | -3.8007 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.016 |
| InChI Key: | ZPZJFSTXMDOXCZ-QFIPXVFZSA-N |