N-{2-[4-(2,4,6-trifluorobenzoyl)piperazin-1-yl]pyridin-3-yl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{2-[4-(2,4,6-trifluorobenzoyl)piperazin-1-yl]pyridin-3-yl}-2H-1,3-benzodioxole-5-carboxamide
N-{2-[4-(2,4,6-trifluorobenzoyl)piperazin-1-yl]pyridin-3-yl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V003-8514 |
| Compound Name: | N-{2-[4-(2,4,6-trifluorobenzoyl)piperazin-1-yl]pyridin-3-yl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 484.43 |
| Molecular Formula: | C24 H19 F3 N4 O4 |
| Salt: | not_available |
| Smiles: | C1CN(CCN1C(c1c(cc(cc1F)F)F)=O)c1c(cccn1)NC(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6045 |
| logD: | 3.5892 |
| logSw: | -3.8909 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.637 |
| InChI Key: | VVZSMMVGCWUBED-UHFFFAOYSA-N |