6-ethoxy-4-({4-[2-oxo-2-(piperidin-1-yl)ethyl]piperazin-1-yl}methyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-ethoxy-4-({4-[2-oxo-2-(piperidin-1-yl)ethyl]piperazin-1-yl}methyl)-2H-1-benzopyran-2-one
6-ethoxy-4-({4-[2-oxo-2-(piperidin-1-yl)ethyl]piperazin-1-yl}methyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | J079-0532 |
| Compound Name: | 6-ethoxy-4-({4-[2-oxo-2-(piperidin-1-yl)ethyl]piperazin-1-yl}methyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C23 H31 N3 O4 |
| Smiles: | CCOc1ccc2c(c1)C(CN1CCN(CC1)CC(N1CCCCC1)=O)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 1.5786 |
| logD: | 1.5421 |
| logSw: | -2.5194 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 51.435 |
| InChI Key: | XLXGHNJJANFITF-UHFFFAOYSA-N |