1-({(2S,4S)-4-fluoro-1-[(3-methoxyphenyl)acetyl]pyrrolidin-2-yl}methyl)-N-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-({(2S,4S)-4-fluoro-1-[(3-methoxyphenyl)acetyl]pyrrolidin-2-yl}methyl)-N-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
1-({(2S,4S)-4-fluoro-1-[(3-methoxyphenyl)acetyl]pyrrolidin-2-yl}methyl)-N-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1444 |
| Compound Name: | 1-({(2S,4S)-4-fluoro-1-[(3-methoxyphenyl)acetyl]pyrrolidin-2-yl}methyl)-N-(propan-2-yl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 403.46 |
| Molecular Formula: | C20 H26 F N5 O3 |
| Smiles: | CC(C)NC(c1cn(C[C@@H]2C[C@@H](CN2C(Cc2cccc(c2)OC)=O)F)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.5496 |
| logD: | 1.5496 |
| logSw: | -1.8449 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.021 |
| InChI Key: | QGVUBSMBBATUJV-JKSUJKDBSA-N |