(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}piperidin-1-yl)(3-fluorophenyl)methanone
Chemical Structure Depiction of
(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}piperidin-1-yl)(3-fluorophenyl)methanone
(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}piperidin-1-yl)(3-fluorophenyl)methanone
Compound characteristics
| Compound ID: | Y031-5712 |
| Compound Name: | (4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}piperidin-1-yl)(3-fluorophenyl)methanone |
| Molecular Weight: | 453.51 |
| Molecular Formula: | C25 H28 F N3 O4 |
| Smiles: | C1CN(CCC1C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O)C(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2455 |
| logD: | 1.7772 |
| logSw: | -2.6178 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.191 |
| InChI Key: | SIQAFTQVRFXTOJ-UHFFFAOYSA-N |