1-oxo-N-{[1-(propan-2-yl)-1H-benzimidazol-2-yl]methyl}-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
1-oxo-N-{[1-(propan-2-yl)-1H-benzimidazol-2-yl]methyl}-1,2-dihydroisoquinoline-4-carboxamide
1-oxo-N-{[1-(propan-2-yl)-1H-benzimidazol-2-yl]methyl}-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y042-6896 |
| Compound Name: | 1-oxo-N-{[1-(propan-2-yl)-1H-benzimidazol-2-yl]methyl}-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 360.41 |
| Molecular Formula: | C21 H20 N4 O2 |
| Smiles: | CC(C)n1c2ccccc2nc1CNC(C1=CNC(c2ccccc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6902 |
| logD: | 2.6844 |
| logSw: | -3.2989 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.398 |
| InChI Key: | RMINNPHMSJASBS-UHFFFAOYSA-N |