1-{[(2S,4S)-4-fluoro-1-{[4-(propan-2-yl)phenyl]methyl}pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[(2S,4S)-4-fluoro-1-{[4-(propan-2-yl)phenyl]methyl}pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
1-{[(2S,4S)-4-fluoro-1-{[4-(propan-2-yl)phenyl]methyl}pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-0891 |
| Compound Name: | 1-{[(2S,4S)-4-fluoro-1-{[4-(propan-2-yl)phenyl]methyl}pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 345.42 |
| Molecular Formula: | C18 H24 F N5 O |
| Smiles: | CC(C)c1ccc(CN2C[C@H](C[C@H]2Cn2cc(C(N)=O)nn2)F)cc1 |
| Stereo: | ABSOLUTE |
| logP: | 2.0867 |
| logD: | 2.0717 |
| logSw: | -2.4532 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.654 |
| InChI Key: | LYGLCPJECURCEJ-JKSUJKDBSA-N |