N-(3,4-dimethoxyphenyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide
N-(3,4-dimethoxyphenyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C138-0713 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide |
| Molecular Weight: | 429.47 |
| Molecular Formula: | C25 H23 N3 O4 |
| Smiles: | COc1ccccc1Nc1c2ccccc2c(cn1)C(Nc1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4512 |
| logD: | 4.3421 |
| logSw: | -4.2898 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.941 |
| InChI Key: | FHRJGIJECIYBFC-UHFFFAOYSA-N |