2-(2-methoxyethyl)-1-oxo-N-[3-(4-propylpiperazin-1-yl)propyl]-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(2-methoxyethyl)-1-oxo-N-[3-(4-propylpiperazin-1-yl)propyl]-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
2-(2-methoxyethyl)-1-oxo-N-[3-(4-propylpiperazin-1-yl)propyl]-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-0548 |
| Compound Name: | 2-(2-methoxyethyl)-1-oxo-N-[3-(4-propylpiperazin-1-yl)propyl]-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 498.69 |
| Molecular Formula: | C27 H38 N4 O3 S |
| Smiles: | CCCN1CCN(CCCNC(C2C(c3cccs3)N(CCOC)C(c3ccccc23)=O)=O)CC1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.0874 |
| logD: | 1.1226 |
| logSw: | -2.8609 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.29 |
| InChI Key: | YIFJWCXWHQZUSY-UHFFFAOYSA-N |