ethyl 1-{1-[4-(4-fluorophenyl)piperazin-1-yl]isoquinoline-7-carbonyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{1-[4-(4-fluorophenyl)piperazin-1-yl]isoquinoline-7-carbonyl}piperidine-4-carboxylate
ethyl 1-{1-[4-(4-fluorophenyl)piperazin-1-yl]isoquinoline-7-carbonyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | L162-0271 |
| Compound Name: | ethyl 1-{1-[4-(4-fluorophenyl)piperazin-1-yl]isoquinoline-7-carbonyl}piperidine-4-carboxylate |
| Molecular Weight: | 490.58 |
| Molecular Formula: | C28 H31 F N4 O3 |
| Smiles: | CCOC(C1CCN(CC1)C(c1ccc2ccnc(c2c1)N1CCN(CC1)c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3241 |
| logD: | 4.3106 |
| logSw: | -4.1452 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.063 |
| InChI Key: | CAEFEKSAGMPXTK-UHFFFAOYSA-N |