1-({(2S,4S)-1-[(2-chlorophenyl)methanesulfonyl]-4-fluoropyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
1-({(2S,4S)-1-[(2-chlorophenyl)methanesulfonyl]-4-fluoropyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
1-({(2S,4S)-1-[(2-chlorophenyl)methanesulfonyl]-4-fluoropyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB21-1366 |
| Compound Name: | 1-({(2S,4S)-1-[(2-chlorophenyl)methanesulfonyl]-4-fluoropyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 401.84 |
| Molecular Formula: | C15 H17 Cl F N5 O3 S |
| Smiles: | C1[C@@H](Cn2cc(C(N)=O)nn2)N(C[C@H]1F)S(Cc1ccccc1[Cl])(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.9264 |
| logD: | 0.9264 |
| logSw: | -2.4139 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.138 |
| InChI Key: | JAVHUNOAQBONSP-NEPJUHHUSA-N |