6-ethoxy-4-({4-[(4-fluorophenyl)methyl]piperazin-1-yl}methyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-ethoxy-4-({4-[(4-fluorophenyl)methyl]piperazin-1-yl}methyl)-2H-1-benzopyran-2-one
6-ethoxy-4-({4-[(4-fluorophenyl)methyl]piperazin-1-yl}methyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D222-0228 |
| Compound Name: | 6-ethoxy-4-({4-[(4-fluorophenyl)methyl]piperazin-1-yl}methyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 396.46 |
| Molecular Formula: | C23 H25 F N2 O3 |
| Smiles: | CCOc1ccc2c(c1)C(CN1CCN(CC1)Cc1ccc(cc1)F)=CC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 3.0544 |
| logD: | 2.8702 |
| logSw: | -3.3546 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 35.042 |
| InChI Key: | LCXHQANCRAFSJV-UHFFFAOYSA-N |