N-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-(pyridin-3-yl)ethyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-(pyridin-3-yl)ethyl}-2H-1,3-benzodioxole-5-carboxamide
N-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-(pyridin-3-yl)ethyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | E155-0314 |
| Compound Name: | N-{2-[4-(4-fluorophenyl)piperazin-1-yl]-2-(pyridin-3-yl)ethyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 448.5 |
| Molecular Formula: | C25 H25 F N4 O3 |
| Smiles: | C(C(c1cccnc1)N1CCN(CC1)c1ccc(cc1)F)NC(c1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8561 |
| logD: | 2.8557 |
| logSw: | -3.1053 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.535 |
| InChI Key: | ABTALAXWNWMKCX-QFIPXVFZSA-N |