dimethyl 5-{2-[4-(4-fluorophenyl)piperazin-1-yl]acetamido}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{2-[4-(4-fluorophenyl)piperazin-1-yl]acetamido}benzene-1,3-dicarboxylate
dimethyl 5-{2-[4-(4-fluorophenyl)piperazin-1-yl]acetamido}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | Y206-1478 |
| Compound Name: | dimethyl 5-{2-[4-(4-fluorophenyl)piperazin-1-yl]acetamido}benzene-1,3-dicarboxylate |
| Molecular Weight: | 429.45 |
| Molecular Formula: | C22 H24 F N3 O5 |
| Smiles: | COC(c1cc(cc(c1)NC(CN1CCN(CC1)c1ccc(cc1)F)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9636 |
| logD: | 3.9633 |
| logSw: | -4.0748 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.728 |
| InChI Key: | FEMDQVAOOOWHPM-UHFFFAOYSA-N |