6-ethoxy-4-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-ethoxy-4-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
6-ethoxy-4-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D154-0046 |
| Compound Name: | 6-ethoxy-4-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 382.43 |
| Molecular Formula: | C22 H23 F N2 O3 |
| Smiles: | CCOc1ccc2c(c1)C(CN1CCN(CC1)c1ccc(cc1)F)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 3.4949 |
| logD: | 3.4899 |
| logSw: | -3.7381 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.762 |
| InChI Key: | JHNJQHGMFGTMQA-UHFFFAOYSA-N |