1-{(2S)-2-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-4,4-difluoropyrrolidin-1-yl}-2-(3-fluorophenyl)ethan-1-one
Chemical Structure Depiction of
1-{(2S)-2-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-4,4-difluoropyrrolidin-1-yl}-2-(3-fluorophenyl)ethan-1-one
1-{(2S)-2-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-4,4-difluoropyrrolidin-1-yl}-2-(3-fluorophenyl)ethan-1-one
Compound characteristics
| Compound ID: | S970-0403 |
| Compound Name: | 1-{(2S)-2-[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]-4,4-difluoropyrrolidin-1-yl}-2-(3-fluorophenyl)ethan-1-one |
| Molecular Weight: | 364.37 |
| Molecular Formula: | C18 H19 F3 N4 O |
| Smiles: | C1CC1Cn1cnnc1[C@@H]1CC(CN1C(Cc1cccc(c1)F)=O)(F)F |
| Stereo: | ABSOLUTE |
| logP: | 2.5194 |
| logD: | 2.5194 |
| logSw: | -2.6983 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.961 |
| InChI Key: | RPZQMRMLLFPRHT-HNNXBMFYSA-N |