N-benzyl-1-({(2S)-1-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-1-({(2S)-1-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
N-benzyl-1-({(2S)-1-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB20-0250 |
| Compound Name: | N-benzyl-1-({(2S)-1-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]pyrrolidin-2-yl}methyl)-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 436.51 |
| Molecular Formula: | C23 H28 N6 O3 |
| Smiles: | Cc1c(CCC(N2CCC[C@H]2Cn2cc(C(NCc3ccccc3)=O)nn2)=O)c(C)on1 |
| Stereo: | ABSOLUTE |
| logP: | 1.7314 |
| logD: | 1.7314 |
| logSw: | -1.8869 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.336 |
| InChI Key: | QCBKYDSKDAIRII-IBGZPJMESA-N |