ethyl 1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]isoquinoline-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]isoquinoline-4-carboxylate
ethyl 1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]isoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | G780-0532 |
| Compound Name: | ethyl 1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]isoquinoline-4-carboxylate |
| Molecular Weight: | 409.91 |
| Molecular Formula: | C23 H24 Cl N3 O2 |
| Smiles: | CCOC(c1cnc(c2ccccc12)N1CCN(CC1)c1cc(ccc1C)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.1787 |
| logD: | 6.1787 |
| logSw: | -6.0142 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.203 |
| InChI Key: | SHGLWMPRNRHCEJ-UHFFFAOYSA-N |