[(2S)-4,4-difluoro-2-{4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl](thiophen-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](thiophen-3-yl)methanone
[(2S)-4,4-difluoro-2-{4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl](thiophen-3-yl)methanone
Compound characteristics
| Compound ID: | S970-0810 |
| Compound Name: | [(2S)-4,4-difluoro-2-{4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl](thiophen-3-yl)methanone |
| Molecular Weight: | 392.4 |
| Molecular Formula: | C18 H15 F3 N4 O S |
| Smiles: | C1[C@@H](c2nncn2Cc2ccc(cc2)F)N(CC1(F)F)C(c1ccsc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.7279 |
| logD: | 2.7279 |
| logSw: | -2.9124 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.983 |
| InChI Key: | MRJJNXATLPHWKR-HNNXBMFYSA-N |