N-(4-ethoxyphenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide
N-(4-ethoxyphenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C128-0086 |
| Compound Name: | N-(4-ethoxyphenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide |
| Molecular Weight: | 413.48 |
| Molecular Formula: | C25 H23 N3 O3 |
| Smiles: | CCOc1ccc(cc1)NC(c1cnc(c2ccccc12)Nc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1976 |
| logD: | 5.194 |
| logSw: | -5.0973 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.415 |
| InChI Key: | KYHYHYKJRGRMMN-UHFFFAOYSA-N |