N-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
N-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-0346 |
| Compound Name: | N-(4-fluorophenyl)-2-(2-methoxyethyl)-1-oxo-3-(thiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 424.49 |
| Molecular Formula: | C23 H21 F N2 O3 S |
| Smiles: | COCCN1C(C(C(Nc2ccc(cc2)F)=O)c2ccccc2C1=O)c1cccs1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5278 |
| logD: | 3.5235 |
| logSw: | -3.7574 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.353 |
| InChI Key: | KXQXGZGIWGNKSU-UHFFFAOYSA-N |