2-(3-methoxyphenyl)-1-oxo-N-[2-(thiophen-3-yl)ethyl]-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(3-methoxyphenyl)-1-oxo-N-[2-(thiophen-3-yl)ethyl]-1,2-dihydroisoquinoline-4-carboxamide
2-(3-methoxyphenyl)-1-oxo-N-[2-(thiophen-3-yl)ethyl]-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-2347 |
| Compound Name: | 2-(3-methoxyphenyl)-1-oxo-N-[2-(thiophen-3-yl)ethyl]-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 404.49 |
| Molecular Formula: | C23 H20 N2 O3 S |
| Smiles: | COc1cccc(c1)N1C=C(C(NCCc2ccsc2)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.8716 |
| logD: | 2.8716 |
| logSw: | -3.6112 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.571 |
| InChI Key: | IIVFSQILOAPXAE-UHFFFAOYSA-N |