2-(4-methoxyphenyl)-N-{3-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]propyl}-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(4-methoxyphenyl)-N-{3-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]propyl}-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
2-(4-methoxyphenyl)-N-{3-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]propyl}-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-1685 |
| Compound Name: | 2-(4-methoxyphenyl)-N-{3-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]propyl}-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 524.66 |
| Molecular Formula: | C32 H36 N4 O3 |
| Smiles: | CC1CN(CCCNC(C2=CN(C(c3ccccc23)=O)c2ccc(cc2)OC)=O)CCN1c1cccc(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9244 |
| logD: | 3.398 |
| logSw: | -4.0361 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.014 |
| InChI Key: | XOOQGUSBSCKXBM-DEOSSOPVSA-N |