2-ethyl-6,7-dimethoxy-4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]isoquinolin-1(2H)-one
Chemical Structure Depiction of
2-ethyl-6,7-dimethoxy-4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]isoquinolin-1(2H)-one
2-ethyl-6,7-dimethoxy-4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C168-0242 |
| Compound Name: | 2-ethyl-6,7-dimethoxy-4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]isoquinolin-1(2H)-one |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C25 H29 N3 O5 |
| Smiles: | CCN1C=C(C(N2CCN(CC2)c2ccc(cc2)OC)=O)c2cc(c(cc2C1=O)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.7255 |
| logD: | 2.7253 |
| logSw: | -3.0774 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.91 |
| InChI Key: | LGKADJIELBTNEP-UHFFFAOYSA-N |