N-(3,4-difluorophenyl)-6',7'-dimethoxy-2'H-spiro[cyclopentane-1,3'-isoquinolin]-1'(4'H)-imine
Chemical Structure Depiction of
N-(3,4-difluorophenyl)-6',7'-dimethoxy-2'H-spiro[cyclopentane-1,3'-isoquinolin]-1'(4'H)-imine
N-(3,4-difluorophenyl)-6',7'-dimethoxy-2'H-spiro[cyclopentane-1,3'-isoquinolin]-1'(4'H)-imine
Compound characteristics
| Compound ID: | 3555-0186 |
| Compound Name: | N-(3,4-difluorophenyl)-6',7'-dimethoxy-2'H-spiro[cyclopentane-1,3'-isoquinolin]-1'(4'H)-imine |
| Molecular Weight: | 372.41 |
| Molecular Formula: | C21 H22 F2 N2 O2 |
| Smiles: | COc1cc2CC3(CCCC3)NC(\c2cc1OC)=N/c1ccc(c(c1)F)F |
| Stereo: | ACHIRAL |
| logP: | 4.4791 |
| logD: | 4.4516 |
| logSw: | -4.4513 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.468 |
| InChI Key: | KAEJIHQKGKMURT-UHFFFAOYSA-N |