N-[2-(3-methylphenyl)ethyl]-2-(2-methylpropyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[2-(3-methylphenyl)ethyl]-2-(2-methylpropyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-[2-(3-methylphenyl)ethyl]-2-(2-methylpropyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-0892 |
| Compound Name: | N-[2-(3-methylphenyl)ethyl]-2-(2-methylpropyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 446.61 |
| Molecular Formula: | C27 H30 N2 O2 S |
| Smiles: | CC(C)CN1C(C(C(NCCc2cccc(C)c2)=O)c2ccccc2C1=O)c1cccs1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0105 |
| logD: | 5.0105 |
| logSw: | -4.5497 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.196 |
| InChI Key: | LMUKETIJVNZEFG-UHFFFAOYSA-N |