2-(2-methoxyethyl)-N-{3-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]propyl}-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(2-methoxyethyl)-N-{3-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]propyl}-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
2-(2-methoxyethyl)-N-{3-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]propyl}-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-0665 |
| Compound Name: | 2-(2-methoxyethyl)-N-{3-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]propyl}-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 560.76 |
| Molecular Formula: | C32 H40 N4 O3 S |
| Smiles: | CC1CN(CCCNC(C2C(c3cccs3)N(CCOC)C(c3ccccc23)=O)=O)CCN1c1cccc(C)c1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9969 |
| logD: | 3.4289 |
| logSw: | -4.0414 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.978 |
| InChI Key: | CNDZFDGPXXKIIO-UHFFFAOYSA-N |