(1-{[(2S)-4,4-difluoro-1-(methanesulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
(1-{[(2S)-4,4-difluoro-1-(methanesulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone
(1-{[(2S)-4,4-difluoro-1-(methanesulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | SB36-0506 |
| Compound Name: | (1-{[(2S)-4,4-difluoro-1-(methanesulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazol-4-yl)(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 363.38 |
| Molecular Formula: | C13 H19 F2 N5 O3 S |
| Smiles: | CS(N1CC(C[C@H]1Cn1cc(C(N2CCCC2)=O)nn1)(F)F)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.1893 |
| logD: | 0.1893 |
| logSw: | -1.2868 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.963 |
| InChI Key: | WHTCRHKJILKGLF-JTQLQIEISA-N |