2-[(2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-6-yl)oxy]-N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}acetamide
Chemical Structure Depiction of
2-[(2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-6-yl)oxy]-N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}acetamide
2-[(2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-6-yl)oxy]-N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}acetamide
Compound characteristics
| Compound ID: | C214-1071 |
| Compound Name: | 2-[(2,2-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-6-yl)oxy]-N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}acetamide |
| Molecular Weight: | 469.56 |
| Molecular Formula: | C26 H32 F N3 O4 |
| Smiles: | CC1(C)CC(c2cc(ccc2O1)OCC(NCCCN1CCN(CC1)c1ccccc1F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.696 |
| logD: | 2.3648 |
| logSw: | -3.3541 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.302 |
| InChI Key: | LUSIPOZYQOWPML-UHFFFAOYSA-N |