N-(5-chloro-2-methoxyphenyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide
N-(5-chloro-2-methoxyphenyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C138-0716 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-1-(2-methoxyanilino)isoquinoline-4-carboxamide |
| Molecular Weight: | 433.89 |
| Molecular Formula: | C24 H20 Cl N3 O3 |
| Smiles: | COc1ccccc1Nc1c2ccccc2c(cn1)C(Nc1cc(ccc1OC)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3674 |
| logD: | 5.255 |
| logSw: | -5.9822 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.613 |
| InChI Key: | JAVBZQJDRLHKDF-UHFFFAOYSA-N |