1-{[(2S)-1-(benzylcarbamoyl)-4,4-difluoropyrrolidin-2-yl]methyl}-N-(2-methoxyethyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[(2S)-1-(benzylcarbamoyl)-4,4-difluoropyrrolidin-2-yl]methyl}-N-(2-methoxyethyl)-1H-1,2,3-triazole-4-carboxamide
1-{[(2S)-1-(benzylcarbamoyl)-4,4-difluoropyrrolidin-2-yl]methyl}-N-(2-methoxyethyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB36-0753 |
| Compound Name: | 1-{[(2S)-1-(benzylcarbamoyl)-4,4-difluoropyrrolidin-2-yl]methyl}-N-(2-methoxyethyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 422.43 |
| Molecular Formula: | C19 H24 F2 N6 O3 |
| Smiles: | COCCNC(c1cn(C[C@@H]2CC(CN2C(NCc2ccccc2)=O)(F)F)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.0266 |
| logD: | 1.0266 |
| logSw: | -1.8048 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.357 |
| InChI Key: | YDJGMHUWFJYHBV-OAHLLOKOSA-N |