ethyl 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]isoquinoline-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]isoquinoline-4-carboxylate
ethyl 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]isoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G780-0540 |
| Compound Name: | ethyl 1-[4-(2,5-dimethylphenyl)piperazin-1-yl]isoquinoline-4-carboxylate |
| Molecular Weight: | 389.5 |
| Molecular Formula: | C24 H27 N3 O2 |
| Smiles: | CCOC(c1cnc(c2ccccc12)N1CCN(CC1)c1cc(C)ccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0541 |
| logD: | 6.0541 |
| logSw: | -5.6301 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.203 |
| InChI Key: | SXTBEYRBZFMANZ-UHFFFAOYSA-N |