N-(4-chloro-2-methoxy-5-methylphenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(4-chloro-2-methoxy-5-methylphenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide
N-(4-chloro-2-methoxy-5-methylphenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C128-0117 |
| Compound Name: | N-(4-chloro-2-methoxy-5-methylphenyl)-1-(4-methoxyanilino)isoquinoline-4-carboxamide |
| Molecular Weight: | 447.92 |
| Molecular Formula: | C25 H22 Cl N3 O3 |
| Smiles: | Cc1cc(c(cc1[Cl])OC)NC(c1cnc(c2ccccc12)Nc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9779 |
| logD: | 5.9724 |
| logSw: | -6.0909 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.224 |
| InChI Key: | XWXWFRGUZORMSK-UHFFFAOYSA-N |