N-[2-(4-chlorophenyl)ethyl]-2-ethyl-6,7-dimethoxy-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-2-ethyl-6,7-dimethoxy-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-[2-(4-chlorophenyl)ethyl]-2-ethyl-6,7-dimethoxy-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C066-1338 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-2-ethyl-6,7-dimethoxy-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 414.89 |
| Molecular Formula: | C22 H23 Cl N2 O4 |
| Smiles: | CCN1C=C(C(NCCc2ccc(cc2)[Cl])=O)c2cc(c(cc2C1=O)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.8735 |
| logD: | 2.8735 |
| logSw: | -3.5805 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.712 |
| InChI Key: | MRWZBNYRJBBWTN-UHFFFAOYSA-N |