N-benzyl-1-({(2S)-1-[(3,4-dimethylphenyl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-1-({(2S)-1-[(3,4-dimethylphenyl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
N-benzyl-1-({(2S)-1-[(3,4-dimethylphenyl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB20-1056 |
| Compound Name: | N-benzyl-1-({(2S)-1-[(3,4-dimethylphenyl)carbamoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 432.52 |
| Molecular Formula: | C24 H28 N6 O2 |
| Smiles: | Cc1ccc(cc1C)NC(N1CCC[C@H]1Cn1cc(C(NCc2ccccc2)=O)nn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.4578 |
| logD: | 3.4578 |
| logSw: | -3.4608 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.646 |
| InChI Key: | FRKWPGDQPCUZDD-NRFANRHFSA-N |