1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-5-(3-oxopiperazin-1-yl)pentane-1,5-dione
Chemical Structure Depiction of
1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-5-(3-oxopiperazin-1-yl)pentane-1,5-dione
1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-5-(3-oxopiperazin-1-yl)pentane-1,5-dione
Compound characteristics
| Compound ID: | IB08-9282 |
| Compound Name: | 1-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)-5-(3-oxopiperazin-1-yl)pentane-1,5-dione |
| Molecular Weight: | 389.45 |
| Molecular Formula: | C20 H27 N3 O5 |
| Smiles: | COc1cc2CCN(Cc2cc1OC)C(CCCC(N1CCNC(C1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.31 |
| logD: | -0.31 |
| logSw: | -1.33 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 154.64 |
| InChI Key: | MFUZMPYOVGHDTF-UHFFFAOYSA-N |