13-(4-cyclohexylpiperazine-1-carbonyl)-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Chemical Structure Depiction of
13-(4-cyclohexylpiperazine-1-carbonyl)-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
13-(4-cyclohexylpiperazine-1-carbonyl)-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Compound characteristics
Compound ID: | C358-0173 |
Compound Name: | 13-(4-cyclohexylpiperazine-1-carbonyl)-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one |
Molecular Weight: | 503.64 |
Molecular Formula: | C30 H37 N3 O4 |
Smiles: | COc1cc2C(C3c4ccccc4CCN3C(c2cc1OC)=O)C(N1CCN(CC1)C1CCCCC1)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 3.8126 |
logD: | 3.4298 |
logSw: | -3.8778 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 50.949 |
InChI Key: | OFWUCCVONKKYED-UHFFFAOYSA-N |