N-benzyl-1-{[(2S)-1-(methanesulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-1-{[(2S)-1-(methanesulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
N-benzyl-1-{[(2S)-1-(methanesulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB20-0279 |
| Compound Name: | N-benzyl-1-{[(2S)-1-(methanesulfonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 363.44 |
| Molecular Formula: | C16 H21 N5 O3 S |
| Smiles: | CS(N1CCC[C@H]1Cn1cc(C(NCc2ccccc2)=O)nn1)(=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.7064 |
| logD: | 0.7064 |
| logSw: | -2.1545 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.429 |
| InChI Key: | ZLCNTALIGOOTQP-AWEZNQCLSA-N |