N-(3-fluoro-4-methylphenyl)-N~2~-[(3-methyl-1-oxoisoquinolin-2(1H)-yl)acetyl]glycinamide
Chemical Structure Depiction of
N-(3-fluoro-4-methylphenyl)-N~2~-[(3-methyl-1-oxoisoquinolin-2(1H)-yl)acetyl]glycinamide
N-(3-fluoro-4-methylphenyl)-N~2~-[(3-methyl-1-oxoisoquinolin-2(1H)-yl)acetyl]glycinamide
Compound characteristics
| Compound ID: | C115-0017 |
| Compound Name: | N-(3-fluoro-4-methylphenyl)-N~2~-[(3-methyl-1-oxoisoquinolin-2(1H)-yl)acetyl]glycinamide |
| Molecular Weight: | 381.41 |
| Molecular Formula: | C21 H20 F N3 O3 |
| Smiles: | CC1=Cc2ccccc2C(N1CC(NCC(Nc1ccc(C)c(c1)F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2863 |
| logD: | 3.2861 |
| logSw: | -3.6451 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.776 |
| InChI Key: | LXKPTXVIUZCDRR-UHFFFAOYSA-N |