N-[2-(morpholin-4-yl)ethyl]-1-oxo-2-(3,4,5-trifluorophenyl)-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[2-(morpholin-4-yl)ethyl]-1-oxo-2-(3,4,5-trifluorophenyl)-1,2-dihydroisoquinoline-4-carboxamide
N-[2-(morpholin-4-yl)ethyl]-1-oxo-2-(3,4,5-trifluorophenyl)-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y041-2988 |
| Compound Name: | N-[2-(morpholin-4-yl)ethyl]-1-oxo-2-(3,4,5-trifluorophenyl)-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 431.41 |
| Molecular Formula: | C22 H20 F3 N3 O3 |
| Smiles: | C(CN1CCOCC1)NC(C1=CN(C(c2ccccc12)=O)c1cc(c(c(c1)F)F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7939 |
| logD: | 1.6811 |
| logSw: | -2.5718 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.9 |
| InChI Key: | YBFUAPXWFUPYBZ-UHFFFAOYSA-N |