N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-4-(4-fluorophenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-4-(4-fluorophenyl)piperazine-1-carboxamide
N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-4-(4-fluorophenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | C097-0308 |
| Compound Name: | N-[5-chloro-2-(trifluoromethyl)-2H-1,3-benzodioxol-2-yl]-4-(4-fluorophenyl)piperazine-1-carboxamide |
| Molecular Weight: | 445.8 |
| Molecular Formula: | C19 H16 Cl F4 N3 O3 |
| Smiles: | C1CN(CCN1C(NC1(C(F)(F)F)Oc2ccc(cc2O1)[Cl])=O)c1ccc(cc1)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6592 |
| logD: | 4.3109 |
| logSw: | -4.9671 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.059 |
| InChI Key: | PMFHLRDGJUZEEN-IBGZPJMESA-N |