1-{[(2S,4S)-1-(cyclohexylacetyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-{[(2S,4S)-1-(cyclohexylacetyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
1-{[(2S,4S)-1-(cyclohexylacetyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-0962 |
| Compound Name: | 1-{[(2S,4S)-1-(cyclohexylacetyl)-4-fluoropyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 337.4 |
| Molecular Formula: | C16 H24 F N5 O2 |
| Smiles: | C1CCC(CC1)CC(N1C[C@H](C[C@H]1Cn1cc(C(N)=O)nn1)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.3281 |
| logD: | 1.3281 |
| logSw: | -1.4444 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.069 |
| InChI Key: | SHVIQOXLUITWEL-QWHCGFSZSA-N |