2-ethyl-4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-6,7-dimethoxyisoquinolin-1(2H)-one
Chemical Structure Depiction of
2-ethyl-4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-6,7-dimethoxyisoquinolin-1(2H)-one
2-ethyl-4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-6,7-dimethoxyisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C168-0236 |
| Compound Name: | 2-ethyl-4-[4-(4-fluorophenyl)piperazine-1-carbonyl]-6,7-dimethoxyisoquinolin-1(2H)-one |
| Molecular Weight: | 439.49 |
| Molecular Formula: | C24 H26 F N3 O4 |
| Smiles: | CCN1C=C(C(N2CCN(CC2)c2ccc(cc2)F)=O)c2cc(c(cc2C1=O)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.7722 |
| logD: | 2.7722 |
| logSw: | -2.9578 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.366 |
| InChI Key: | LBAGYGIFCDPAMV-UHFFFAOYSA-N |