N-benzyl-1-({(2S)-1-[(2-phenylethyl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-1-({(2S)-1-[(2-phenylethyl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
N-benzyl-1-({(2S)-1-[(2-phenylethyl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB20-0227 |
| Compound Name: | N-benzyl-1-({(2S)-1-[(2-phenylethyl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 432.52 |
| Molecular Formula: | C24 H28 N6 O2 |
| Smiles: | C1C[C@@H](Cn2cc(C(NCc3ccccc3)=O)nn2)N(C1)C(NCCc1ccccc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.6495 |
| logD: | 2.6495 |
| logSw: | -2.8157 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.81 |
| InChI Key: | UBTYINUYOGPUEQ-NRFANRHFSA-N |