N-benzyl-1-{[(2S)-1-(5-methyl-1,2-oxazole-3-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
N-benzyl-1-{[(2S)-1-(5-methyl-1,2-oxazole-3-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
N-benzyl-1-{[(2S)-1-(5-methyl-1,2-oxazole-3-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | SB20-0991 |
| Compound Name: | N-benzyl-1-{[(2S)-1-(5-methyl-1,2-oxazole-3-carbonyl)pyrrolidin-2-yl]methyl}-1H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 394.43 |
| Molecular Formula: | C20 H22 N6 O3 |
| Smiles: | Cc1cc(C(N2CCC[C@H]2Cn2cc(C(NCc3ccccc3)=O)nn2)=O)no1 |
| Stereo: | ABSOLUTE |
| logP: | 1.6694 |
| logD: | 1.6694 |
| logSw: | -1.9932 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.054 |
| InChI Key: | JZYPSRJPNPKZRS-INIZCTEOSA-N |