N-(3,3-diethoxypropyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(3,3-diethoxypropyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide
N-(3,3-diethoxypropyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C066-1569 |
| Compound Name: | N-(3,3-diethoxypropyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide |
| Molecular Weight: | 423.51 |
| Molecular Formula: | C24 H29 N3 O4 |
| Smiles: | CCOC(CCNC(c1cnc(c2ccccc12)Nc1ccccc1OC)=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.8858 |
| logD: | 3.5526 |
| logSw: | -3.8846 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.77 |
| InChI Key: | CNOQSALUMJWGDW-UHFFFAOYSA-N |