[(2S)-4,4-difluoro-2-{4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl](5-methyl-1,2-oxazol-3-yl)methanone
Chemical Structure Depiction of
[(2S)-4,4-difluoro-2-{4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl](5-methyl-1,2-oxazol-3-yl)methanone
[(2S)-4,4-difluoro-2-{4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl](5-methyl-1,2-oxazol-3-yl)methanone
Compound characteristics
| Compound ID: | S970-0793 |
| Compound Name: | [(2S)-4,4-difluoro-2-{4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl](5-methyl-1,2-oxazol-3-yl)methanone |
| Molecular Weight: | 391.35 |
| Molecular Formula: | C18 H16 F3 N5 O2 |
| Smiles: | Cc1cc(C(N2CC(C[C@H]2c2nncn2Cc2ccc(cc2)F)(F)F)=O)no1 |
| Stereo: | ABSOLUTE |
| logP: | 2.276 |
| logD: | 2.276 |
| logSw: | -2.6523 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 62.193 |
| InChI Key: | RLNFJJKMLLHDRH-HNNXBMFYSA-N |