1-{[(2S,4S)-4-fluoro-1-(3-methylbutyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[(2S,4S)-4-fluoro-1-(3-methylbutyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
1-{[(2S,4S)-4-fluoro-1-(3-methylbutyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-0945 |
| Compound Name: | 1-{[(2S,4S)-4-fluoro-1-(3-methylbutyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 283.35 |
| Molecular Formula: | C13 H22 F N5 O |
| Smiles: | CC(C)CCN1C[C@H](C[C@H]1Cn1cc(C(N)=O)nn1)F |
| Stereo: | ABSOLUTE |
| logP: | 0.8648 |
| logD: | 0.8165 |
| logSw: | -0.6441 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.904 |
| InChI Key: | DVMWLIAMMAGOEQ-WDEREUQCSA-N |