N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y041-7597 |
| Compound Name: | N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-methoxyethyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 390.44 |
| Molecular Formula: | C22 H22 N4 O3 |
| Smiles: | COCCN1C=C(C(NCCc2nc3ccccc3[nH]2)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 1.5414 |
| logD: | 1.5405 |
| logSw: | -2.3142 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.329 |
| InChI Key: | IEBCFTPVWNYBKX-UHFFFAOYSA-N |