2-{4-[(6-ethoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}-N-(4-fluoro-2-methylphenyl)acetamide
Chemical Structure Depiction of
2-{4-[(6-ethoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}-N-(4-fluoro-2-methylphenyl)acetamide
2-{4-[(6-ethoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}-N-(4-fluoro-2-methylphenyl)acetamide
Compound characteristics
| Compound ID: | J079-0640 |
| Compound Name: | 2-{4-[(6-ethoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}-N-(4-fluoro-2-methylphenyl)acetamide |
| Molecular Weight: | 453.51 |
| Molecular Formula: | C25 H28 F N3 O4 |
| Smiles: | CCOc1ccc2c(c1)C(CN1CCN(CC1)CC(Nc1ccc(cc1C)F)=O)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 3.1062 |
| logD: | 3.0984 |
| logSw: | -3.2563 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.494 |
| InChI Key: | FDEYOVBSPPALGG-UHFFFAOYSA-N |