[(2S,4S)-1-(3-chloro-4-fluorobenzene-1-sulfonyl)-4-fluoropyrrolidin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone
Chemical Structure Depiction of
[(2S,4S)-1-(3-chloro-4-fluorobenzene-1-sulfonyl)-4-fluoropyrrolidin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone
[(2S,4S)-1-(3-chloro-4-fluorobenzene-1-sulfonyl)-4-fluoropyrrolidin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone
Compound characteristics
| Compound ID: | S254-0686 |
| Compound Name: | [(2S,4S)-1-(3-chloro-4-fluorobenzene-1-sulfonyl)-4-fluoropyrrolidin-2-yl](3,4-dihydroisoquinolin-2(1H)-yl)methanone |
| Molecular Weight: | 440.89 |
| Molecular Formula: | C20 H19 Cl F2 N2 O3 S |
| Smiles: | C1CN(Cc2ccccc12)C([C@@H]1C[C@@H](CN1S(c1ccc(c(c1)[Cl])F)(=O)=O)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.4448 |
| logD: | 3.4448 |
| logSw: | -3.7376 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.03 |
| InChI Key: | PFAYAAPHTJSBHS-BEFAXECRSA-N |