6-ethoxy-4-{[4-(phenylacetyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-ethoxy-4-{[4-(phenylacetyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
6-ethoxy-4-{[4-(phenylacetyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D222-0154 |
| Compound Name: | 6-ethoxy-4-{[4-(phenylacetyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 406.48 |
| Molecular Formula: | C24 H26 N2 O4 |
| Smiles: | CCOc1ccc2c(c1)C(CN1CCN(CC1)C(Cc1ccccc1)=O)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 2.7796 |
| logD: | 2.7783 |
| logSw: | -3.4144 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.431 |
| InChI Key: | VLWWWEADYTWCIF-UHFFFAOYSA-N |