N-[3-(4-ethylpiperazin-1-yl)propyl]-2-methyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[3-(4-ethylpiperazin-1-yl)propyl]-2-methyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-[3-(4-ethylpiperazin-1-yl)propyl]-2-methyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C154-0129 |
| Compound Name: | N-[3-(4-ethylpiperazin-1-yl)propyl]-2-methyl-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 440.61 |
| Molecular Formula: | C24 H32 N4 O2 S |
| Smiles: | CCN1CCN(CCCNC(C2C(c3cccs3)N(C)C(c3ccccc23)=O)=O)CC1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.3805 |
| logD: | 0.4323 |
| logSw: | -2.3186 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.481 |
| InChI Key: | YPYKQTYKHDWWBH-UHFFFAOYSA-N |