2-cyclopentyl-N-{3-[ethyl(3-methylphenyl)amino]propyl}-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-cyclopentyl-N-{3-[ethyl(3-methylphenyl)amino]propyl}-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
2-cyclopentyl-N-{3-[ethyl(3-methylphenyl)amino]propyl}-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-1114 |
| Compound Name: | 2-cyclopentyl-N-{3-[ethyl(3-methylphenyl)amino]propyl}-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 515.72 |
| Molecular Formula: | C31 H37 N3 O2 S |
| Smiles: | CCN(CCCNC(C1C(c2cccs2)N(C2CCCC2)C(c2ccccc12)=O)=O)c1cccc(C)c1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5226 |
| logD: | 5.4903 |
| logSw: | -5.331 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.502 |
| InChI Key: | NFPIZAOVZOWASG-UHFFFAOYSA-N |