[(2S)-4,4-difluoro-1-(3-fluoro-4-methoxybenzoyl)pyrrolidin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone
Chemical Structure Depiction of
[(2S)-4,4-difluoro-1-(3-fluoro-4-methoxybenzoyl)pyrrolidin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone
[(2S)-4,4-difluoro-1-(3-fluoro-4-methoxybenzoyl)pyrrolidin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone
Compound characteristics
| Compound ID: | CM4572-7223 |
| Compound Name: | [(2S)-4,4-difluoro-1-(3-fluoro-4-methoxybenzoyl)pyrrolidin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone |
| Molecular Weight: | 418.41 |
| Molecular Formula: | C22 H21 F3 N2 O3 |
| Smiles: | COc1ccc(cc1F)C(N1CC(C[C@H]1C(N1CCc2ccccc2C1)=O)(F)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.3371 |
| logD: | 3.3371 |
| logSw: | -3.5423 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.821 |
| InChI Key: | XDTCRCHOQBMDIP-SFHVURJKSA-N |