N-[(1H-benzimidazol-2-yl)methyl]-2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[(1H-benzimidazol-2-yl)methyl]-2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-[(1H-benzimidazol-2-yl)methyl]-2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y041-7613 |
| Compound Name: | N-[(1H-benzimidazol-2-yl)methyl]-2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 376.41 |
| Molecular Formula: | C21 H20 N4 O3 |
| Smiles: | COCCN1C=C(C(NCc2nc3ccccc3[nH]2)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 1.707 |
| logD: | 1.7052 |
| logSw: | -2.3937 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.488 |
| InChI Key: | VHZWBTVIWGQOER-UHFFFAOYSA-N |