N-(3-chloro-4-methoxyphenyl)-2-ethyl-6,7-dimethoxy-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-ethyl-6,7-dimethoxy-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-(3-chloro-4-methoxyphenyl)-2-ethyl-6,7-dimethoxy-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
Compound ID: | C168-0158 |
Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-ethyl-6,7-dimethoxy-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
Molecular Weight: | 416.86 |
Molecular Formula: | C21 H21 Cl N2 O5 |
Smiles: | CCN1C=C(C(Nc2ccc(c(c2)[Cl])OC)=O)c2cc(c(cc2C1=O)OC)OC |
Stereo: | ACHIRAL |
logP: | 3.2867 |
logD: | 3.1719 |
logSw: | -3.6412 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.179 |
InChI Key: | LRDGUZJEYDWEIN-UHFFFAOYSA-N |