1-{[(2S,4S)-1-(3,4-difluorobenzoyl)-4-fluoropyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[(2S,4S)-1-(3,4-difluorobenzoyl)-4-fluoropyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
1-{[(2S,4S)-1-(3,4-difluorobenzoyl)-4-fluoropyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1005 |
| Compound Name: | 1-{[(2S,4S)-1-(3,4-difluorobenzoyl)-4-fluoropyrrolidin-2-yl]methyl}-N,N-dimethyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 381.36 |
| Molecular Formula: | C17 H18 F3 N5 O2 |
| Smiles: | CN(C)C(c1cn(C[C@@H]2C[C@@H](CN2C(c2ccc(c(c2)F)F)=O)F)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.5894 |
| logD: | 0.5894 |
| logSw: | -1.5044 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 59.346 |
| InChI Key: | GFQKXZADKOKVJA-NEPJUHHUSA-N |