2-{[(2S)-4,4-difluoro-1-(3-fluorobenzene-1-sulfonyl)pyrrolidin-2-yl]methyl}-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
2-{[(2S)-4,4-difluoro-1-(3-fluorobenzene-1-sulfonyl)pyrrolidin-2-yl]methyl}-1,2,3,4-tetrahydroisoquinoline
2-{[(2S)-4,4-difluoro-1-(3-fluorobenzene-1-sulfonyl)pyrrolidin-2-yl]methyl}-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | CM4573-7631 |
| Compound Name: | 2-{[(2S)-4,4-difluoro-1-(3-fluorobenzene-1-sulfonyl)pyrrolidin-2-yl]methyl}-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 410.46 |
| Molecular Formula: | C20 H21 F3 N2 O2 S |
| Smiles: | C1CN(Cc2ccccc12)C[C@@H]1CC(CN1S(c1cccc(c1)F)(=O)=O)(F)F |
| Stereo: | ABSOLUTE |
| logP: | 3.7803 |
| logD: | 3.7802 |
| logSw: | -4.0358 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.066 |
| InChI Key: | DXNFIETXYOAOBS-SFHVURJKSA-N |