[(2S)-1-(3-chloro-4-fluorobenzoyl)-4,4-difluoropyrrolidin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone
Chemical Structure Depiction of
[(2S)-1-(3-chloro-4-fluorobenzoyl)-4,4-difluoropyrrolidin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone
[(2S)-1-(3-chloro-4-fluorobenzoyl)-4,4-difluoropyrrolidin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone
Compound characteristics
| Compound ID: | CM4572-7228 |
| Compound Name: | [(2S)-1-(3-chloro-4-fluorobenzoyl)-4,4-difluoropyrrolidin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone |
| Molecular Weight: | 422.83 |
| Molecular Formula: | C21 H18 Cl F3 N2 O2 |
| Smiles: | C1CN(Cc2ccccc12)C([C@@H]1CC(CN1C(c1ccc(c(c1)[Cl])F)=O)(F)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.7665 |
| logD: | 3.7665 |
| logSw: | -4.3973 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.19 |
| InChI Key: | ZLVUMBXBFSMRLA-SFHVURJKSA-N |