N-[(2-ethoxyphenyl)methyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]isoquinoline-7-carboxamide
Chemical Structure Depiction of
N-[(2-ethoxyphenyl)methyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]isoquinoline-7-carboxamide
N-[(2-ethoxyphenyl)methyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]isoquinoline-7-carboxamide
Compound characteristics
| Compound ID: | L162-0371 |
| Compound Name: | N-[(2-ethoxyphenyl)methyl]-1-[4-(4-fluorophenyl)piperazin-1-yl]isoquinoline-7-carboxamide |
| Molecular Weight: | 484.57 |
| Molecular Formula: | C29 H29 F N4 O2 |
| Smiles: | CCOc1ccccc1CNC(c1ccc2ccnc(c2c1)N1CCN(CC1)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6899 |
| logD: | 5.6763 |
| logSw: | -5.7017 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.284 |
| InChI Key: | JZCZYMBSQUNXKI-UHFFFAOYSA-N |