N-benzyl-1-{[(2S)-1-(cyclopropanecarbonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-1-{[(2S)-1-(cyclopropanecarbonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
N-benzyl-1-{[(2S)-1-(cyclopropanecarbonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB36-1159 |
| Compound Name: | N-benzyl-1-{[(2S)-1-(cyclopropanecarbonyl)-4,4-difluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 389.4 |
| Molecular Formula: | C19 H21 F2 N5 O2 |
| Smiles: | C1CC1C(N1CC(C[C@H]1Cn1cc(C(NCc2ccccc2)=O)nn1)(F)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.8229 |
| logD: | 1.8228 |
| logSw: | -2.0801 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.282 |
| InChI Key: | KWHIRSRWCWIGDY-OAHLLOKOSA-N |