2-{4-[(6-ethoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}-N-methyl-N-phenylacetamide
Chemical Structure Depiction of
2-{4-[(6-ethoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}-N-methyl-N-phenylacetamide
2-{4-[(6-ethoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}-N-methyl-N-phenylacetamide
Compound characteristics
| Compound ID: | J079-0603 |
| Compound Name: | 2-{4-[(6-ethoxy-2-oxo-2H-1-benzopyran-4-yl)methyl]piperazin-1-yl}-N-methyl-N-phenylacetamide |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C25 H29 N3 O4 |
| Smiles: | CCOc1ccc2c(c1)C(CN1CCN(CC1)CC(N(C)c1ccccc1)=O)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 1.8254 |
| logD: | 1.8185 |
| logSw: | -2.8418 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.156 |
| InChI Key: | NFPWBQWRWFYDFH-UHFFFAOYSA-N |