2-(4-methoxyphenyl)-N-{3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl}-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(4-methoxyphenyl)-N-{3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl}-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
2-(4-methoxyphenyl)-N-{3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl}-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-1696 |
| Compound Name: | 2-(4-methoxyphenyl)-N-{3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl}-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 526.64 |
| Molecular Formula: | C31 H34 N4 O4 |
| Smiles: | COc1ccc(cc1)N1C=C(C(NCCCN2CCN(CC2)c2ccccc2OC)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.0206 |
| logD: | 2.6459 |
| logSw: | -3.6845 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.125 |
| InChI Key: | HYNCTEILXFAMBR-UHFFFAOYSA-N |