1-(3-chloro-4-methylanilino)-N-(3,4,5-trimethoxyphenyl)isoquinoline-4-carboxamide
Chemical Structure Depiction of
1-(3-chloro-4-methylanilino)-N-(3,4,5-trimethoxyphenyl)isoquinoline-4-carboxamide
1-(3-chloro-4-methylanilino)-N-(3,4,5-trimethoxyphenyl)isoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C066-1907 |
| Compound Name: | 1-(3-chloro-4-methylanilino)-N-(3,4,5-trimethoxyphenyl)isoquinoline-4-carboxamide |
| Molecular Weight: | 477.95 |
| Molecular Formula: | C26 H24 Cl N3 O4 |
| Smiles: | Cc1ccc(cc1[Cl])Nc1c2ccccc2c(cn1)C(Nc1cc(c(c(c1)OC)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6171 |
| logD: | 5.6131 |
| logSw: | -5.9801 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.726 |
| InChI Key: | XXUGNKDESKPVQU-UHFFFAOYSA-N |