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 |