N-(2,4-difluorophenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(2,4-difluorophenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide
N-(2,4-difluorophenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C128-0022 |
| Compound Name: | N-(2,4-difluorophenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide |
| Molecular Weight: | 405.4 |
| Molecular Formula: | C23 H17 F2 N3 O2 |
| Smiles: | COc1ccc(cc1)Nc1c2ccccc2c(cn1)C(Nc1ccc(cc1F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9428 |
| logD: | 4.9317 |
| logSw: | -4.7139 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 48.594 |
| InChI Key: | CQCUSZVVZOUJJC-UHFFFAOYSA-N |