ethyl {4-[(6-ethyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}acetate
Chemical Structure Depiction of
ethyl {4-[(6-ethyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}acetate
ethyl {4-[(6-ethyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}acetate
Compound characteristics
| Compound ID: | J079-0894 |
| Compound Name: | ethyl {4-[(6-ethyl-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}acetate |
| Molecular Weight: | 358.44 |
| Molecular Formula: | C20 H26 N2 O4 |
| Smiles: | CCc1ccc2c(c1)C(CN1CCN(CC1)CC(=O)OCC)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 2.0761 |
| logD: | 1.9895 |
| logSw: | -2.9923 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 48.349 |
| InChI Key: | ZFHRCIGEHUNIMO-UHFFFAOYSA-N |