[(2S,4S)-1-(4-chlorobenzene-1-sulfonyl)-4-fluoropyrrolidin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone
Chemical Structure Depiction of
[(2S,4S)-1-(4-chlorobenzene-1-sulfonyl)-4-fluoropyrrolidin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone
[(2S,4S)-1-(4-chlorobenzene-1-sulfonyl)-4-fluoropyrrolidin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone
Compound characteristics
| Compound ID: | S254-0495 |
| Compound Name: | [(2S,4S)-1-(4-chlorobenzene-1-sulfonyl)-4-fluoropyrrolidin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone |
| Molecular Weight: | 422.9 |
| Molecular Formula: | C20 H20 Cl F N2 O3 S |
| Smiles: | C1CN(Cc2ccccc12)C([C@@H]1C[C@@H](CN1S(c1ccc(cc1)[Cl])(=O)=O)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.5435 |
| logD: | 3.5435 |
| logSw: | -3.9138 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.03 |
| InChI Key: | MLMWTJVPFSIGOQ-MJGOQNOKSA-N |