(1-{[(2S)-1-(benzenesulfonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(morpholin-4-yl)methanone
Chemical Structure Depiction of
(1-{[(2S)-1-(benzenesulfonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(morpholin-4-yl)methanone
(1-{[(2S)-1-(benzenesulfonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(morpholin-4-yl)methanone
Compound characteristics
| Compound ID: | SB36-0631 |
| Compound Name: | (1-{[(2S)-1-(benzenesulfonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(morpholin-4-yl)methanone |
| Molecular Weight: | 441.45 |
| Molecular Formula: | C18 H21 F2 N5 O4 S |
| Smiles: | C1[C@@H](Cn2cc(C(N3CCOCC3)=O)nn2)N(CC1(F)F)S(c1ccccc1)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.7695 |
| logD: | 0.7695 |
| logSw: | -2.0862 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 83.742 |
| InChI Key: | VVPMJUNAMIFKSX-AWEZNQCLSA-N |