13-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Chemical Structure Depiction of
13-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
13-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Compound characteristics
Compound ID: | C358-0171 |
Compound Name: | 13-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one |
Molecular Weight: | 515.57 |
Molecular Formula: | C29 H29 N3 O6 |
Smiles: | COc1cc2C(C3c4ccccc4CCN3C(c2cc1OC)=O)C(N1CCN(CC1)C(c1ccco1)=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.3637 |
logD: | 2.3637 |
logSw: | -2.8907 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 72.89 |
InChI Key: | XUANZVDCTOTIGA-UHFFFAOYSA-N |