N-(2-ethoxyphenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(2-ethoxyphenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide
N-(2-ethoxyphenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide
Compound characteristics
Compound ID: | C128-0102 |
Compound Name: | N-(2-ethoxyphenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide |
Molecular Weight: | 413.48 |
Molecular Formula: | C25 H23 N3 O3 |
Smiles: | CCOc1ccccc1NC(c1cnc(c2ccccc12)Nc1ccc(cc1)OC)=O |
Stereo: | ACHIRAL |
logP: | 5.2015 |
logD: | 5.1978 |
logSw: | -5.0874 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 55.804 |
InChI Key: | ZXGKXVGZENEKFB-UHFFFAOYSA-N |