2-(2-methoxyphenyl)-1-oxo-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(2-methoxyphenyl)-1-oxo-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,2-dihydroisoquinoline-4-carboxamide
2-(2-methoxyphenyl)-1-oxo-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C033-0470 |
| Compound Name: | 2-(2-methoxyphenyl)-1-oxo-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 496.57 |
| Molecular Formula: | C29 H28 N4 O4 |
| Smiles: | COc1ccccc1N1C=C(C(NCC(N2CCN(CC2)c2ccccc2)=O)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.5718 |
| logD: | 2.5717 |
| logSw: | -3.1505 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.15 |
| InChI Key: | WVUIPXNTNXMVBY-UHFFFAOYSA-N |