1-[4-(4-fluorophenyl)piperazin-1-yl]-N-[(5-methylfuran-2-yl)methyl]isoquinoline-7-carboxamide
Chemical Structure Depiction of
1-[4-(4-fluorophenyl)piperazin-1-yl]-N-[(5-methylfuran-2-yl)methyl]isoquinoline-7-carboxamide
1-[4-(4-fluorophenyl)piperazin-1-yl]-N-[(5-methylfuran-2-yl)methyl]isoquinoline-7-carboxamide
Compound characteristics
| Compound ID: | L162-0339 |
| Compound Name: | 1-[4-(4-fluorophenyl)piperazin-1-yl]-N-[(5-methylfuran-2-yl)methyl]isoquinoline-7-carboxamide |
| Molecular Weight: | 444.51 |
| Molecular Formula: | C26 H25 F N4 O2 |
| Smiles: | Cc1ccc(CNC(c2ccc3ccnc(c3c2)N2CCN(CC2)c2ccc(cc2)F)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.138 |
| logD: | 5.1244 |
| logSw: | -5.2339 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.337 |
| InChI Key: | VEGKFHUYBUIMJS-UHFFFAOYSA-N |