N-(4-bromo-2-methylphenyl)-1-(3-chloro-4-methylanilino)isoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-methylphenyl)-1-(3-chloro-4-methylanilino)isoquinoline-4-carboxamide
N-(4-bromo-2-methylphenyl)-1-(3-chloro-4-methylanilino)isoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C066-1909 |
| Compound Name: | N-(4-bromo-2-methylphenyl)-1-(3-chloro-4-methylanilino)isoquinoline-4-carboxamide |
| Molecular Weight: | 480.79 |
| Molecular Formula: | C24 H19 Br Cl N3 O |
| Smiles: | Cc1cc(ccc1NC(c1cnc(c2ccccc12)Nc1ccc(C)c(c1)[Cl])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 7.2529 |
| logD: | 7.2491 |
| logSw: | -6.4412 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.05 |
| InChI Key: | IUPCXHINZSYLQX-UHFFFAOYSA-N |