1-(2-methoxyanilino)-N-[(4-methoxyphenyl)methyl]isoquinoline-4-carboxamide
Chemical Structure Depiction of
1-(2-methoxyanilino)-N-[(4-methoxyphenyl)methyl]isoquinoline-4-carboxamide
1-(2-methoxyanilino)-N-[(4-methoxyphenyl)methyl]isoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C066-1593 |
| Compound Name: | 1-(2-methoxyanilino)-N-[(4-methoxyphenyl)methyl]isoquinoline-4-carboxamide |
| Molecular Weight: | 413.48 |
| Molecular Formula: | C25 H23 N3 O3 |
| Smiles: | COc1ccc(CNC(c2cnc(c3ccccc23)Nc2ccccc2OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8623 |
| logD: | 4.3754 |
| logSw: | -4.6465 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.546 |
| InChI Key: | OZUFFCBXJIEEEC-UHFFFAOYSA-N |