2-(3,5-dimethoxybenzamido)-N-(2-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(3,5-dimethoxybenzamido)-N-(2-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
2-(3,5-dimethoxybenzamido)-N-(2-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C125-1270 |
| Compound Name: | 2-(3,5-dimethoxybenzamido)-N-(2-fluorophenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 461.45 |
| Molecular Formula: | C25 H20 F N3 O5 |
| Smiles: | COc1cc(cc(c1)OC)C(NN1C=C(C(Nc2ccccc2F)=O)c2ccccc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2065 |
| logD: | 3.1672 |
| logSw: | -3.7791 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.542 |
| InChI Key: | ZJEMVKKICDKUTD-UHFFFAOYSA-N |