ethyl 1-(2,5-difluoroanilino)isoquinoline-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(2,5-difluoroanilino)isoquinoline-4-carboxylate
ethyl 1-(2,5-difluoroanilino)isoquinoline-4-carboxylate
Compound characteristics
Compound ID: | G780-0620 |
Compound Name: | ethyl 1-(2,5-difluoroanilino)isoquinoline-4-carboxylate |
Molecular Weight: | 328.32 |
Molecular Formula: | C18 H14 F2 N2 O2 |
Smiles: | CCOC(c1cnc(c2ccccc12)Nc1cc(ccc1F)F)=O |
Stereo: | ACHIRAL |
logP: | 4.8624 |
logD: | 4.8623 |
logSw: | -4.5916 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 38.712 |
InChI Key: | NZCJRKKCKGRHJW-UHFFFAOYSA-N |