N-(3-chlorophenyl)-6,7-dimethoxy-2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-6,7-dimethoxy-2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-(3-chlorophenyl)-6,7-dimethoxy-2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C168-0425 |
| Compound Name: | N-(3-chlorophenyl)-6,7-dimethoxy-2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 414.89 |
| Molecular Formula: | C22 H23 Cl N2 O4 |
| Smiles: | CC(C)CN1C=C(C(Nc2cccc(c2)[Cl])=O)c2cc(c(cc2C1=O)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.4684 |
| logD: | 4.4102 |
| logSw: | -4.5887 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.824 |
| InChI Key: | XNFPAVJVNWLYSC-UHFFFAOYSA-N |