2-ethyl-4-(4-ethylpiperazine-1-carbonyl)-6,7-dimethoxyisoquinolin-1(2H)-one
Chemical Structure Depiction of
2-ethyl-4-(4-ethylpiperazine-1-carbonyl)-6,7-dimethoxyisoquinolin-1(2H)-one
2-ethyl-4-(4-ethylpiperazine-1-carbonyl)-6,7-dimethoxyisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C168-0241 |
| Compound Name: | 2-ethyl-4-(4-ethylpiperazine-1-carbonyl)-6,7-dimethoxyisoquinolin-1(2H)-one |
| Molecular Weight: | 373.45 |
| Molecular Formula: | C20 H27 N3 O4 |
| Smiles: | CCN1CCN(CC1)C(C1=CN(CC)C(c2cc(c(cc12)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1491 |
| logD: | 0.8542 |
| logSw: | -1.7978 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.642 |
| InChI Key: | HCCXKAPAFCEUHL-UHFFFAOYSA-N |