2-(4-methoxyphenyl)-1-oxo-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(4-methoxyphenyl)-1-oxo-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,2-dihydroisoquinoline-4-carboxamide
2-(4-methoxyphenyl)-1-oxo-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-1694 |
| Compound Name: | 2-(4-methoxyphenyl)-1-oxo-N-[3-(4-phenylpiperazin-1-yl)propyl]-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 496.61 |
| Molecular Formula: | C30 H32 N4 O3 |
| Smiles: | COc1ccc(cc1)N1C=C(C(NCCCN2CCN(CC2)c2ccccc2)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.0199 |
| logD: | 2.476 |
| logSw: | -3.5686 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.796 |
| InChI Key: | ACCKGHDSOQYBGW-UHFFFAOYSA-N |