(3,4-dihydroisoquinolin-2(1H)-yl)[(2S,4S)-4-fluoro-1-(4-methoxybenzene-1-sulfonyl)pyrrolidin-2-yl]methanone
Chemical Structure Depiction of
(3,4-dihydroisoquinolin-2(1H)-yl)[(2S,4S)-4-fluoro-1-(4-methoxybenzene-1-sulfonyl)pyrrolidin-2-yl]methanone
(3,4-dihydroisoquinolin-2(1H)-yl)[(2S,4S)-4-fluoro-1-(4-methoxybenzene-1-sulfonyl)pyrrolidin-2-yl]methanone
Compound characteristics
| Compound ID: | S254-0599 |
| Compound Name: | (3,4-dihydroisoquinolin-2(1H)-yl)[(2S,4S)-4-fluoro-1-(4-methoxybenzene-1-sulfonyl)pyrrolidin-2-yl]methanone |
| Molecular Weight: | 418.49 |
| Molecular Formula: | C21 H23 F N2 O4 S |
| Smiles: | COc1ccc(cc1)S(N1C[C@H](C[C@H]1C(N1CCc2ccccc2C1)=O)F)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.9311 |
| logD: | 2.9311 |
| logSw: | -3.3848 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.574 |
| InChI Key: | BEXUFVLEGPXTIK-XLIONFOSSA-N |