1-({(2S)-4,4-difluoro-1-[3-(4-methoxyphenyl)propanoyl]pyrrolidin-2-yl}methyl)-N-methyl-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-({(2S)-4,4-difluoro-1-[3-(4-methoxyphenyl)propanoyl]pyrrolidin-2-yl}methyl)-N-methyl-1H-1,2,3-triazole-4-carboxamide
1-({(2S)-4,4-difluoro-1-[3-(4-methoxyphenyl)propanoyl]pyrrolidin-2-yl}methyl)-N-methyl-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB36-0107 |
| Compound Name: | 1-({(2S)-4,4-difluoro-1-[3-(4-methoxyphenyl)propanoyl]pyrrolidin-2-yl}methyl)-N-methyl-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 407.42 |
| Molecular Formula: | C19 H23 F2 N5 O3 |
| Smiles: | CNC(c1cn(C[C@@H]2CC(CN2C(CCc2ccc(cc2)OC)=O)(F)F)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.4138 |
| logD: | 1.4138 |
| logSw: | -2.0684 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.197 |
| InChI Key: | YTXUUOLGUNKFJB-CQSZACIVSA-N |