[(2S)-4,4-difluoro-2-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](thiophen-3-yl)methanone
Chemical Structure Depiction of
[(2S)-4,4-difluoro-2-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](thiophen-3-yl)methanone
[(2S)-4,4-difluoro-2-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](thiophen-3-yl)methanone
Compound characteristics
| Compound ID: | SB35-0053 |
| Compound Name: | [(2S)-4,4-difluoro-2-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](thiophen-3-yl)methanone |
| Molecular Weight: | 298.31 |
| Molecular Formula: | C12 H12 F2 N4 O S |
| Smiles: | Cc1nc([C@@H]2CC(CN2C(c2ccsc2)=O)(F)F)[nH]n1 |
| Stereo: | ABSOLUTE |
| logP: | 1.6832 |
| logD: | 1.6826 |
| logSw: | -2.5233 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.296 |
| InChI Key: | QQBVLNRZFFPIDO-VIFPVBQESA-N |