2-cyclopentyl-N-[2-(3-methylphenyl)ethyl]-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-cyclopentyl-N-[2-(3-methylphenyl)ethyl]-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
2-cyclopentyl-N-[2-(3-methylphenyl)ethyl]-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-1232 |
| Compound Name: | 2-cyclopentyl-N-[2-(3-methylphenyl)ethyl]-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 458.62 |
| Molecular Formula: | C28 H30 N2 O2 S |
| Smiles: | Cc1cccc(CCNC(C2C(c3cccs3)N(C3CCCC3)C(c3ccccc23)=O)=O)c1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.898 |
| logD: | 4.898 |
| logSw: | -4.5435 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.512 |
| InChI Key: | NUMNSRRCUVAUKN-UHFFFAOYSA-N |