methyl 1-[4-(pyridin-2-yl)piperazin-1-yl]isoquinoline-4-carboxylate
Chemical Structure Depiction of
methyl 1-[4-(pyridin-2-yl)piperazin-1-yl]isoquinoline-4-carboxylate
methyl 1-[4-(pyridin-2-yl)piperazin-1-yl]isoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G780-0068 |
| Compound Name: | methyl 1-[4-(pyridin-2-yl)piperazin-1-yl]isoquinoline-4-carboxylate |
| Molecular Weight: | 348.4 |
| Molecular Formula: | C20 H20 N4 O2 |
| Smiles: | COC(c1cnc(c2ccccc12)N1CCN(CC1)c1ccccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0201 |
| logD: | 4.0145 |
| logSw: | -4.1006 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.435 |
| InChI Key: | HBFLZJRSYUJLIV-UHFFFAOYSA-N |